data_2k9p_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 2k9p _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 ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo . . . . . 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo . . . . . 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.47 0.527 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.405 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.405 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo . . . . . 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 119.095 -0.479 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.0 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.404 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 91.4 t . . . . . 0 N--CA 1.47 0.525 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.233 -0.413 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 N--CA 1.469 0.475 0 CA-C-O 119.056 -0.497 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 38.1 t . . . . . 0 N--CA 1.467 0.407 0 CA-C-O 118.732 -0.652 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 119.487 -0.292 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 118.742 -0.646 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo . . . . . 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 55.3 t . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 94.2 t . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 119.368 -0.348 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -106.84 -178.37 3.63 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.045 1.338 . . . . 0.0 110.46 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.98 161.24 19.16 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 121.753 0.641 . . . . 0.0 113.05 174.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 p -145.15 111.19 5.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.039 1.336 . . . . 0.0 110.027 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.5 t -91.94 14.68 15.01 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.187 1.395 . . . . 0.0 112.938 178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.9 mm -74.52 157.99 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.041 0.936 . . . . 0.0 109.905 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.59 158.97 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.033 1.333 . . . . 0.0 112.679 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -59.04 -16.5 18.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -66.86 152.12 81.04 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.9 pt -51.31 -39.24 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.155 0.982 . . . . 0.0 112.472 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -61.38 -41.06 96.49 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.252 1.021 . . . . 0.0 111.582 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.78 -53.98 37.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 124.174 0.99 . . . . 0.0 109.328 176.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.02 -48.05 89.42 Favored 'Isoleucine or valine' 0 C--N 1.344 0.328 0 O-C-N 123.615 0.572 . . . . 0.0 110.307 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.93 -46.37 89.6 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.748 -0.595 . . . . 0.0 112.453 177.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -55.45 -58.82 6.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.17 0.988 . . . . 0.0 110.597 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.9 m -63.67 -42.29 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.25 -30.08 69.04 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.3 t -51.92 -33.82 38.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.732 1.613 . . . . 0.0 112.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -81.42 -41.25 22.15 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -59.07 -68.6 0.26 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.365 1.066 . . . . 0.0 112.477 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 t 176.3 141.71 0.07 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.665 1.586 . . . . 0.0 110.242 -178.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.6 t -110.81 16.16 21.48 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.537 1.135 . . . . 0.0 112.855 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.97 106.14 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.307 1.843 . . . . 0.0 110.575 -177.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 C--O 1.262 1.721 0 CA-C-O 116.566 -1.683 . . . . 0.0 111.238 175.685 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -161.95 156.73 22.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.264 1.426 . . . . 0.0 110.451 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.75 -174.62 23.45 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.576 1.084 . . . . 0.0 111.99 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 m -138.35 149.14 45.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.844 1.658 . . . . 0.0 109.417 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t 47.51 30.14 1.57 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.412 1.485 . . . . 0.0 113.693 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.4 mm -75.35 151.59 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 123.936 0.894 . . . . 0.0 109.629 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.51 161.95 1.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.601 1.16 . . . . 0.0 112.87 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -61.98 -8.2 4.89 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.01 145.47 61.59 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.2 pt -49.28 -39.89 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 124.47 1.108 . . . . 0.0 112.57 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -44.07 96.35 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.712 1.205 . . . . 0.0 111.939 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mt -55.8 -56.89 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 109.139 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.99 -40.87 87.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 122.565 0.346 . . . . 0.0 111.776 -175.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.49 -54.44 45.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.455 0.702 . . . . 0.0 110.763 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.47 -42.31 91.75 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.787 -0.625 . . . . 0.0 112.09 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.5 t -55.14 -68.46 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 110.102 176.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.29 -34.8 70.93 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.5 m -56.76 -23.91 46.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.244 1.818 . . . . 0.0 113.164 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -106.14 -34.53 7.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.961 0.904 . . . . 0.0 112.53 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -61.13 -35.13 76.23 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.434 1.016 . . . . 0.0 112.847 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t -76.09 84.4 2.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.279 0.632 . . . . 0.0 111.695 176.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 58.3 m -128.12 84.1 2.21 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.822 1.249 . . . . 0.0 111.877 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 p -165.96 126.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.229 1.412 . . . . 0.0 109.377 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.3 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 117.155 -1.402 . . . . 0.0 110.276 172.555 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -164.68 176.02 9.23 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.494 1.518 . . . . 0.0 109.961 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.57 -161.21 12.88 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.982 1.277 . . . . 0.0 112.553 173.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.0 m -54.35 100.29 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.242 1.417 . . . . 0.0 112.005 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.8 t -121.34 23.32 10.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.305 1.842 . . . . 0.0 112.026 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.0 mp -128.99 163.33 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.264 1.426 . . . . 0.0 109.062 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.36 166.54 2.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.697 1.599 . . . . 0.0 112.124 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -62.63 -17.57 60.58 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 177.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -67.11 153.92 76.07 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -47.62 -41.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 124.334 1.053 . . . . 0.0 112.041 176.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -63.07 -46.04 89.33 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.092 0.957 . . . . 0.0 112.553 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.1 mt -58.14 -56.89 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 123.519 0.728 . . . . 0.0 109.503 172.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.9 mm -62.66 -41.17 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.397 0.544 . . . . 0.0 112.253 -172.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -56.79 -52.8 63.65 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.961 0.904 . . . . 0.0 110.11 174.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -57.66 -42.87 84.38 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 117.847 -1.073 . . . . 0.0 112.541 175.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.78 -62.07 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 119.391 0.996 . . . . 0.0 110.174 176.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.73 -27.98 62.37 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.3 t -51.65 -32.27 28.8 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.441 1.896 . . . . 0.0 112.815 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -84.52 -26.4 28.11 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -79.94 -56.77 4.02 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.052 1.341 . . . . 0.0 112.332 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.6 m -118.02 110.17 17.35 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.518 1.127 . . . . 0.0 110.456 -175.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.3 t -78.49 23.09 0.32 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.562 1.145 . . . . 0.0 113.827 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.2 t -131.69 87.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.993 2.117 . . . . 0.0 109.321 -175.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.538 1.535 . . . . 0.0 112.67 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 110.054 -1.218 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -143.05 166.36 24.85 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.437 1.095 . . . . 0.0 110.813 176.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.59 -144.29 5.58 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.815 0.721 . . . . 0.0 112.655 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -153.19 154.63 35.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.11 1.364 . . . . 0.0 108.98 172.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.5 t 44.03 34.51 0.96 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.708 1.603 . . . . 0.0 114.417 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -70.74 156.85 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 O-C-N 121.055 -1.028 . . . . 0.0 109.799 -176.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.12 160.73 1.98 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.792 1.237 . . . . 0.0 112.611 172.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -60.5 -16.64 38.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.265 1.026 . . . . 0.0 113.284 178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.405 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.405 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.5 153.69 69.79 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.0 pt -50.92 -39.13 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.401 1.081 . . . . 0.0 112.439 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -64.94 -36.47 84.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.346 1.058 . . . . 0.0 112.134 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -54.86 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.69 -43.13 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 O-C-N 123.367 0.417 . . . . 0.0 111.21 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.47 -44.52 94.21 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.263 1.025 . . . . 0.0 112.992 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -59.93 -57.63 12.06 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.863 0.756 . . . . 0.0 110.994 176.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.0 m -59.49 -45.83 93.42 Favored 'Isoleucine or valine' 0 C--N 1.342 0.274 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -34.51 71.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.9 t -53.32 -51.39 62.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.077 1.351 . . . . 0.0 111.289 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -70.38 -28.61 65.24 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -62.36 -26.9 68.71 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.4 t -118.94 -167.38 1.38 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.443 1.097 . . . . 0.0 112.351 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 16.4 t -101.02 119.75 39.19 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.131 0.972 . . . . 0.0 110.957 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.8 p -163.49 128.64 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 126.34 1.856 . . . . 0.0 108.87 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 115.968 -1.967 . . . . 0.0 110.368 171.841 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.354 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -142.67 113.43 7.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.562 1.545 . . . . 0.0 109.292 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.1 167.21 31.49 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.55 0.595 . . . . 0.0 113.247 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.1 m -110.13 84.4 1.92 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.231 1.413 . . . . 0.0 110.291 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.1 t -138.9 31.52 2.22 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.091 1.757 . . . . 0.0 112.025 -178.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.22 152.95 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 124.32 1.048 . . . . 0.0 109.703 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.98 171.5 3.5 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.168 1.787 . . . . 0.0 112.017 174.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -66.3 -17.46 64.77 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.32 151.98 71.59 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.4 pt -51.03 -38.27 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.488 1.115 . . . . 0.0 112.774 176.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.63 -41.69 97.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.085 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.43 -54.56 33.39 Favored 'Isoleucine or valine' 0 C--N 1.345 0.394 0 C-N-CA 123.864 0.866 . . . . 0.0 108.931 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.9 mm -63.18 -41.62 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.098 0.559 . . . . 0.0 111.479 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -67.05 -46.08 75.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.244 0.618 . . . . 0.0 111.806 177.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.23 -58.46 8.12 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.501 1.121 . . . . 0.0 111.456 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.2 m -60.55 -42.05 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.93 -31.46 71.79 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.8 t -52.27 -43.59 64.48 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.898 1.679 . . . . 0.0 112.419 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -74.26 -41.66 60.9 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.308 0.504 . . . . 0.0 111.621 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -57.65 -39.99 78.3 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.9 t -72.38 79.3 1.02 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 111.191 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -107.77 159.49 16.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.331 1.452 . . . . 0.0 112.346 174.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -162.12 132.32 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 126.804 2.042 . . . . 0.0 108.166 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . 0.266 14.7 t . . . . . 0 C--O 1.256 1.411 0 CA-C-O 114.752 -2.546 . . . . 0.0 111.421 173.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 108.856 -1.698 . . . . 0.0 108.856 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -153.73 149.34 27.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.465 1.132 . . . . 0.0 109.625 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.89 171.02 47.34 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.141 0.876 . . . . 0.0 113.457 -176.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 m -123.46 148.78 45.85 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.488 1.515 . . . . 0.0 109.699 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t 46.91 32.81 1.96 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.607 1.563 . . . . 0.0 114.041 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.8 mm -76.71 146.77 8.24 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.406 -0.809 . . . . 0.0 109.871 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.55 161.03 2.89 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.386 1.474 . . . . 0.0 112.794 174.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -66.87 -18.49 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.769 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.77 145.31 62.53 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.4 pt -48.09 -40.68 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -46.18 89.13 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.745 1.218 . . . . 0.0 111.762 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mt -55.75 -55.93 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.554 0.742 . . . . 0.0 109.432 173.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.5 mm -61.8 -38.81 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -57.81 -57.48 12.58 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.758 0.823 . . . . 0.0 110.051 176.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -55.75 -42.17 75.01 Favored 'General case' 0 C--N 1.344 0.345 0 C-N-CA 123.937 0.895 . . . . 0.0 111.851 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.1 t -57.03 -69.6 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.413 1.085 . . . . 0.0 110.435 175.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -31.91 65.33 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.7 p -58.03 -40.18 80.22 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.833 0.853 . . . . 0.0 112.328 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.09 -32.61 50.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.454 1.102 . . . . 0.0 112.703 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.06 -22.98 67.23 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 175.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t -117.08 178.23 4.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 112.119 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.0 m -81.72 94.6 7.03 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.317 -0.864 . . . . 0.0 110.096 174.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.4 t -132.15 90.68 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.162 0.985 . . . . 0.0 110.383 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.708 1.603 . . . . 0.0 111.591 175.028 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 CA-C-O 118.431 -1.205 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -146.25 120.55 9.59 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.07 1.348 . . . . 0.0 109.646 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.83 102.18 0.08 OUTLIER Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.366 0.984 . . . . 0.0 113.725 175.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 p -141.99 118.43 10.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.241 1.016 . . . . 0.0 110.441 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -101.04 18.84 18.68 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.485 1.514 . . . . 0.0 112.124 177.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 20.8 mm -73.8 150.32 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 O-C-N 121.294 -0.879 . . . . 0.0 109.206 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.89 173.45 0.6 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.772 1.629 . . . . 0.0 113.063 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -69.59 -8.27 45.89 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 120.64 -1.288 . . . . 0.0 113.957 177.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -68.18 126.32 14.22 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.8 pt -48.64 -39.37 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.677 1.191 . . . . 0.0 112.906 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -56.8 -44.3 81.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.497 1.119 . . . . 0.0 111.156 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.1 mm -61.93 -59.33 4.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.206 0 C-N-CA 123.948 0.899 . . . . 0.0 110.053 175.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.6 mm -57.1 -41.51 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 122.736 0.414 . . . . 0.0 111.403 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -60.83 -51.0 71.17 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.979 0.912 . . . . 0.0 111.878 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -53.61 -45.94 70.24 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.739 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.0 t -54.72 -59.35 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.219 0.608 . . . . 0.0 110.099 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.58 -31.59 72.8 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -52.57 -49.01 65.82 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.868 1.267 . . . . 0.0 111.038 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -62.56 -40.3 96.42 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -57.77 -27.67 63.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 113.153 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.9 t -131.99 54.8 1.91 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.036 0.935 . . . . 0.0 111.66 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 p -105.02 141.19 37.03 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.983 0.913 . . . . 0.0 111.239 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.53 106.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 126.687 1.995 . . . . 0.0 110.277 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 C--O 1.254 1.342 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.51 176.245 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.335 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -159.71 151.55 20.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.084 1.754 . . . . 0.0 109.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.78 -167.49 6.77 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 123.589 0.614 . . . . 0.0 114.28 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -123.5 76.04 1.38 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.287 1.435 . . . . 0.0 110.819 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.0 t -118.03 26.47 9.63 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.997 1.719 . . . . 0.0 112.372 -177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -105.01 155.22 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 109.593 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.55 175.69 1.01 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.805 1.642 . . . . 0.0 112.287 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -78.52 -11.41 59.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.759 -1.213 . . . . 0.0 113.698 175.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.95 145.72 62.83 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 20.8 pt -49.01 -40.15 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.692 1.197 . . . . 0.0 112.554 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.03 -41.81 97.29 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.523 1.129 . . . . 0.0 111.876 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.1 mt -58.72 -56.97 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 123.559 0.744 . . . . 0.0 109.552 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.6 mm -60.05 -43.59 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.017 0.527 . . . . 0.0 112.263 -173.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -59.26 -48.82 80.19 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.753 0.821 . . . . 0.0 110.805 177.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -48.94 74.09 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.343 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -52.56 -55.5 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 118.529 0.604 . . . . 0.0 109.765 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -36.58 80.24 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.6 p -55.61 -39.24 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.093 1.357 . . . . 0.0 113.161 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -72.11 -46.69 55.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.798 0.839 . . . . 0.0 110.752 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -56.17 -52.18 65.3 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.883 0.873 . . . . 0.0 112.668 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.2 t -152.05 147.02 25.99 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.424 . . . . 0.0 111.013 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.9 t -135.61 103.75 5.55 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.58 0.752 . . . . 0.0 111.124 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -163.01 124.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.19 1.396 . . . . 0.0 109.914 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.0 m . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.65 1.58 . . . . 0.0 111.263 173.097 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.127 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -148.21 162.95 38.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.306 1.443 . . . . 0.0 109.467 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.69 161.38 17.13 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 125.182 1.372 . . . . 0.0 110.53 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.2 t -151.49 158.61 43.86 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.243 1.417 . . . . 0.0 109.189 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.4 t 47.32 26.66 0.76 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.854 1.662 . . . . 0.0 114.093 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.5 mm -70.94 153.36 8.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 120.794 -1.191 . . . . 0.0 109.34 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.91 160.12 1.02 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.432 1.493 . . . . 0.0 112.285 172.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -63.52 -13.44 41.2 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.404 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.12 151.98 76.75 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -43.9 -44.74 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 125.404 1.482 . . . . 0.0 114.0 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -56.99 -48.09 79.26 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.853 0.861 . . . . 0.0 112.243 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.1 mp -64.64 -40.75 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 C-N-CA 124.237 1.015 . . . . 0.0 109.686 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.0 mm -64.89 -34.31 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 119.244 0.929 . . . . 0.0 112.404 176.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -72.75 -51.28 19.77 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.364 -0.835 . . . . 0.0 112.21 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -47.0 85.71 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.394 -0.812 . . . . 0.0 111.868 176.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.16 -46.1 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 119.321 0.964 . . . . 0.0 111.059 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -31.05 71.6 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.0 m -54.33 -36.22 63.53 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.225 1.41 . . . . 0.0 112.583 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -77.57 -48.06 17.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.504 0.593 . . . . 0.0 111.891 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -59.37 -61.35 2.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.777 0.831 . . . . 0.0 113.061 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.2 m -68.82 -65.55 0.69 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.385 0.674 . . . . 0.0 110.137 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 t 59.58 13.57 3.43 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.7 m -134.37 106.66 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 126.961 2.104 . . . . 0.0 110.486 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.998 -1.477 . . . . 0.0 111.379 172.947 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 CA-C-O 118.746 -1.03 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -170.22 -178.64 2.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.592 1.557 . . . . 0.0 109.55 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.04 -176.7 8.32 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.259 0.933 . . . . 0.0 113.986 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.0 p -105.4 93.14 4.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.829 2.052 . . . . 0.0 110.679 -172.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.8 t -135.24 25.51 3.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.954 1.301 . . . . 0.0 112.408 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -87.02 155.62 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 121.578 0.704 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.6 171.79 1.87 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.907 1.283 . . . . 0.0 111.606 175.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -60.76 -12.71 11.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.96 152.38 68.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.7 pt -51.31 -39.7 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.414 1.086 . . . . 0.0 112.534 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -41.25 95.37 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.108 0.963 . . . . 0.0 111.576 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.59 -52.51 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 124.863 1.265 . . . . 0.0 108.987 174.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.5 mm -62.23 -31.26 50.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 118.831 0.742 . . . . 0.0 111.832 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -67.36 -58.5 4.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.236 1.014 . . . . 0.0 112.505 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.35 -46.31 83.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.839 0.456 . . . . 0.0 111.429 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.0 -47.67 89.42 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -31.64 72.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -51.83 -39.69 59.23 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.85 1.26 . . . . 0.0 112.432 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.14 -37.74 45.37 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -56.94 -52.45 65.16 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.538 0.735 . . . . 0.0 111.761 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.4 t -162.71 138.09 6.95 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.0 0.52 . . . . 0.0 111.089 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.4 t -119.25 15.05 13.09 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.631 1.172 . . . . 0.0 112.093 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -167.81 121.06 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.92 2.088 . . . . 0.0 110.957 -175.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 125.257 1.423 . . . . 0.0 112.037 175.171 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.417 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -121.81 -63.17 1.33 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.024 0.93 . . . . 0.0 111.283 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.83 156.75 27.91 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.513 1.054 . . . . 0.0 112.43 -174.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.0 m -129.06 82.33 2.08 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.542 1.137 . . . . 0.0 109.541 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.4 t -132.72 30.0 4.11 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.725 1.61 . . . . 0.0 111.685 -174.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -109.92 154.14 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.383 1.473 . . . . 0.0 109.859 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.42 160.4 2.36 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.048 1.739 . . . . 0.0 113.124 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -63.4 -13.55 40.93 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.58 150.87 83.8 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 11.1 pt -47.4 -44.1 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.208 1.003 . . . . 0.0 111.97 177.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -56.7 -45.16 81.97 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.581 1.152 . . . . 0.0 113.009 178.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.66 -54.7 30.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 175.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.7 mm -61.75 -44.89 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.535 0.607 . . . . 0.0 112.069 -175.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -55.54 -50.66 69.43 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.386 1.074 . . . . 0.0 111.723 174.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -56.8 -49.0 76.68 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.264 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 91.4 t -51.31 -57.27 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 123.799 0.84 . . . . 0.0 110.482 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -28.65 67.72 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -59.93 -57.54 12.44 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.751 1.22 . . . . 0.0 112.478 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -74.8 -6.22 47.77 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.56 -174.19 0.84 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.567 1.547 . . . . 0.0 111.423 170.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 9.7 t -49.85 94.27 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.512 1.525 . . . . 0.0 113.509 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.1 m -99.15 6.88 46.26 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.805 1.242 . . . . 0.0 112.609 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -163.09 125.8 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 126.923 2.089 . . . . 0.0 109.386 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 115.778 -2.058 . . . . 0.0 113.102 175.431 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.743 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -65.89 104.67 1.14 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.004 1.402 . . . . 0.0 110.657 -178.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -161.85 -48.81 0.02 OUTLIER Glycine 0 CA--C 1.531 1.088 0 N-CA-C 114.939 0.736 . . . . 0.0 114.939 -178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 t -145.01 161.55 39.12 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.382 1.073 . . . . 0.0 110.518 173.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.2 t 43.0 31.75 0.36 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.942 1.697 . . . . 0.0 113.881 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.48 157.93 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 121.049 -1.032 . . . . 0.0 109.364 -176.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.18 161.85 1.19 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.849 1.659 . . . . 0.0 112.227 172.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -59.53 -14.86 14.63 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.18 151.19 84.2 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.3 pt -47.65 -45.09 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.517 1.127 . . . . 0.0 111.93 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -55.53 -45.53 77.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.027 1.331 . . . . 0.0 112.927 177.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.83 -53.76 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.9 mm -60.04 -47.84 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.139 0.427 . . . . 0.0 111.55 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -57.74 -45.04 86.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.722 0.809 . . . . 0.0 111.623 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -55.75 -51.97 65.53 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-O 117.881 -1.056 . . . . 0.0 111.641 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.4 t -50.76 -54.8 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.826 0.739 . . . . 0.0 109.977 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.73 -35.69 80.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -52.06 -34.8 45.1 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.678 1.591 . . . . 0.0 112.594 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.59 -41.15 18.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.32 -52.3 66.23 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.632 0.773 . . . . 0.0 113.033 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 t -168.64 152.42 5.62 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.34 0.656 . . . . 0.0 111.2 175.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 76.6 p -97.11 145.38 26.05 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.73 -0.606 . . . . 0.0 111.496 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.37 104.93 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.168 1.387 . . . . 0.0 109.739 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.63 -1.652 . . . . 0.0 110.872 169.902 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -152.5 139.84 19.49 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.628 1.171 . . . . 0.0 109.581 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.72 173.59 13.0 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.63 1.586 . . . . 0.0 112.309 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -142.74 166.99 23.13 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.483 1.913 . . . . 0.0 109.624 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.4 t 44.76 29.89 0.48 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.522 1.529 . . . . 0.0 114.553 -177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.66 157.67 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 123.385 0.674 . . . . 0.0 109.43 -176.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.27 164.91 1.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.493 1.517 . . . . 0.0 112.074 175.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -83.22 -9.23 59.26 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.258 -0.901 . . . . 0.0 113.303 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.04 112.42 2.5 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.5 pt -45.08 -37.69 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.752 1.621 . . . . 0.0 113.602 176.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -55.54 -52.17 64.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.04 1.336 . . . . 0.0 111.473 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.09 -52.01 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 124.66 1.184 . . . . 0.0 109.408 175.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.1 mm -57.16 -45.74 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.084 0.402 . . . . 0.0 111.286 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -59.88 -47.73 84.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.836 0.854 . . . . 0.0 111.999 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -54.99 -46.03 75.11 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.827 173.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.77 -56.09 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 123.082 0.553 . . . . 0.0 109.758 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -36.09 83.25 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.3 m -65.86 -46.5 78.23 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.352 1.061 . . . . 0.0 112.213 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -59.46 -35.44 74.07 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -59.85 -38.99 83.7 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.4 t -164.75 119.2 1.35 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.713 0.688 . . . . 0.0 111.685 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 77.6 p -120.75 159.91 24.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.236 1.415 . . . . 0.0 112.004 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.0 m -143.03 119.55 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 126.148 1.779 . . . . 0.0 109.927 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.238 0 C-N-CA 126.879 2.072 . . . . 0.0 112.54 170.655 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.182 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -76.8 -179.87 5.67 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.595 0.758 . . . . 0.0 112.344 175.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.5 99.67 0.13 Allowed Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.822 1.201 . . . . 0.0 111.928 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -143.23 153.83 43.21 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.292 1.437 . . . . 0.0 110.319 173.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t 43.5 33.29 0.62 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 126.55 1.94 . . . . 0.0 113.605 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.97 155.71 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.093 -1.004 . . . . 0.0 109.711 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.74 156.45 3.61 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 125.79 1.636 . . . . 0.0 112.007 173.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -63.04 -12.5 26.73 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.47 153.15 74.47 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.1 pt -49.1 -40.28 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 124.469 1.108 . . . . 0.0 112.779 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -59.99 -46.7 88.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.607 1.163 . . . . 0.0 112.61 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.41 -50.74 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.369 1.068 . . . . 0.0 109.471 176.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -64.8 -38.42 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.857 -0.527 . . . . 0.0 111.514 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.23 -63.02 1.29 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 110.404 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -54.86 -43.68 73.33 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.394 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 38.1 t -56.65 -67.81 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.992 1.317 . . . . 0.0 110.618 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.62 -57.16 9.84 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.0 p -62.52 -23.83 67.17 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.132 0.973 . . . . 0.0 112.983 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -99.38 11.92 37.78 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.83 1.652 . . . . 0.0 112.515 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -86.29 -57.94 2.82 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.122 0.874 . . . . 0.0 111.852 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.8 t -75.62 68.13 2.19 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.911 1.284 . . . . 0.0 110.514 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 t -160.9 136.63 8.08 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.673 0.789 . . . . 0.0 111.126 175.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 47.4 t -136.69 90.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 125.226 1.41 . . . . 0.0 108.739 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.624 -1.655 . . . . 0.0 111.342 175.066 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.448 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -81.81 -39.56 23.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.49 173.46 21.72 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.773 1.177 . . . . 0.0 112.595 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 m -131.46 80.8 1.95 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.145 1.378 . . . . 0.0 110.449 -175.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.3 t -129.35 36.23 4.16 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.527 1.931 . . . . 0.0 111.222 -177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -131.42 156.37 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.651 1.18 . . . . 0.0 108.737 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.0 163.1 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.44 1.896 . . . . 0.0 111.948 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -62.07 -10.64 10.68 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.25 129.1 21.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.8 pt -47.98 -40.43 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.99 1.316 . . . . 0.0 112.584 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -47.33 76.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.821 1.648 . . . . 0.0 111.586 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.9 mm -60.29 -58.93 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.083 0.953 . . . . 0.0 109.764 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.44 -41.78 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 CA-C-N 118.281 0.491 . . . . 0.0 111.555 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.12 -56.39 22.67 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.554 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -50.45 -43.84 55.33 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.133 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.4 t -59.22 -61.13 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 118.913 0.779 . . . . 0.0 110.736 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 -38.64 10.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.0 t -62.28 -33.75 75.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.796 1.238 . . . . 0.0 112.133 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -70.22 -37.1 74.95 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -62.69 -59.62 4.64 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.778 0.717 . . . . 0.0 112.21 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.6 t -139.34 129.38 25.09 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.629 1.172 . . . . 0.0 109.092 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 7.1 t -101.36 166.49 10.72 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.33 1.052 . . . . 0.0 111.076 175.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 p -167.77 123.48 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 126.375 1.87 . . . . 0.0 109.249 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 116.688 -1.625 . . . . 0.0 110.225 173.119 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 m120 63.34 31.65 15.12 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.426 1.09 . . . . 0.0 112.859 174.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.53 -164.23 27.88 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 124.871 1.224 . . . . 0.0 112.671 -173.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.5 m -134.99 87.62 2.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.63 1.572 . . . . 0.0 109.085 176.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.0 t -124.31 26.44 7.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.806 1.642 . . . . 0.0 111.42 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -118.44 150.77 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.533 1.533 . . . . 0.0 109.25 -177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.33 168.54 1.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.755 2.022 . . . . 0.0 112.327 174.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -68.78 -15.85 63.63 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.63 113.82 2.87 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.4 pt -47.87 -34.16 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.173 1.389 . . . . 0.0 113.833 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.56 -49.27 76.93 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.468 1.107 . . . . 0.0 111.178 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mt -59.73 -52.34 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.616 1.167 . . . . 0.0 110.12 172.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.4 mm -58.06 -42.64 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.609 0.64 . . . . 0.0 111.021 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -64.56 -48.72 73.97 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.538 0.735 . . . . 0.0 112.809 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -56.02 -55.67 30.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.354 0.525 . . . . 0.0 111.83 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m -63.05 -42.57 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.14 -34.63 78.47 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.5 m -58.91 -18.18 31.01 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.643 1.577 . . . . 0.0 113.755 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -102.95 -27.84 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.75 -44.2 74.24 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 176.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 88.3 p -138.52 -178.07 5.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 110.482 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 69.4 m 62.88 19.82 11.79 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.8 m -138.49 105.31 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.59 1.956 . . . . 0.0 110.439 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.039 173.414 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.218 0 CA-C-O 117.953 -1.471 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -141.3 139.71 33.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.559 1.18 . . . . 0.0 108.514 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.74 -177.74 39.42 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.276 0.941 . . . . 0.0 112.821 175.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.8 t -114.57 86.59 2.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.0 0.92 . . . . 0.0 110.719 -176.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.1 t -128.1 30.63 5.2 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.052 1.741 . . . . 0.0 112.609 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.86 154.31 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.648 1.179 . . . . 0.0 109.196 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.02 173.75 1.77 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.116 1.366 . . . . 0.0 111.699 174.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -68.6 -16.24 63.79 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.54 131.53 21.73 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 16.5 pt -49.92 -42.68 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.548 1.139 . . . . 0.0 112.292 175.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -41.88 70.73 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.224 1.41 . . . . 0.0 112.4 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.4 mm -63.21 -60.15 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.684 0.794 . . . . 0.0 109.487 173.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.0 mm -57.17 -40.94 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.745 0.702 . . . . 0.0 111.955 -174.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -57.96 -54.9 41.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.08 0.952 . . . . 0.0 111.882 173.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -54.62 -40.21 68.69 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.251 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.47 -67.06 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 124.142 0.977 . . . . 0.0 110.841 177.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -48.33 68.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.3 m -62.46 -21.63 65.6 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.828 0.851 . . . . 0.0 112.728 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -89.6 -34.88 16.16 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.108 0.963 . . . . 0.0 112.381 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.57 -64.67 0.87 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.981 1.312 . . . . 0.0 112.671 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -77.07 77.65 3.61 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.181 0.593 . . . . 0.0 110.644 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 62.8 m -73.13 116.96 14.28 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.39 1.076 . . . . 0.0 111.777 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.22 94.24 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.836 1.254 . . . . 0.0 109.626 176.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.82 1.648 . . . . 0.0 112.493 169.994 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.23 172.25 13.19 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.067 1.747 . . . . 0.0 110.001 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.32 161.01 38.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.375 0.512 . . . . 0.0 113.375 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.9 m -100.99 75.41 1.67 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.443 1.097 . . . . 0.0 111.188 -174.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t -139.75 35.5 1.99 Allowed 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.369 1.08 . . . . 0.0 112.494 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -99.64 155.08 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.199 -0.938 . . . . 0.0 109.079 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.01 175.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.323 1.849 . . . . 0.0 112.111 174.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -68.94 -15.02 63.38 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.18 -1.575 . . . . 0.0 114.135 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -68.22 145.5 66.54 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -49.12 -41.09 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.138 0.975 . . . . 0.0 112.344 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -60.17 -42.1 94.25 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.337 1.055 . . . . 0.0 112.305 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 mt -58.79 -55.17 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.961 0.904 . . . . 0.0 109.734 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.4 mm -63.82 -34.02 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.776 -0.577 . . . . 0.0 111.682 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.09 -61.92 2.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.478 1.111 . . . . 0.0 110.337 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -57.14 -37.89 72.71 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-O 118.453 -0.784 . . . . 0.0 112.131 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.21 -63.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.118 0.967 . . . . 0.0 110.142 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -36.16 82.84 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 41.6 t -60.47 -49.5 77.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.35 1.46 . . . . 0.0 111.151 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -61.58 -43.19 99.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -59.71 -33.13 71.21 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 m -104.95 76.89 1.28 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.631 1.572 . . . . 0.0 112.172 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.56 14.5 11.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.225 1.01 . . . . 0.0 113.417 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.2 p -167.86 123.76 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.099 2.16 . . . . 0.0 109.082 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 116.671 -1.633 . . . . 0.0 110.278 171.782 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 CA-C-O 119.237 -0.757 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -158.84 113.01 2.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.186 0.994 . . . . 0.0 110.908 170.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -172.62 175.64 45.67 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.221 0.915 . . . . 0.0 112.725 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.9 p -111.68 71.65 0.75 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.224 1.81 . . . . 0.0 111.285 -173.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.3 t -129.18 27.91 5.32 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.846 1.258 . . . . 0.0 112.91 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.2 mm -72.61 157.08 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.593 0.711 . . . . 0.0 110.398 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.1 157.44 6.01 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.481 1.913 . . . . 0.0 112.321 174.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -64.26 -16.74 62.69 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.65 128.92 19.96 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 18.5 pt -48.83 -37.99 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.524 1.13 . . . . 0.0 112.768 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.78 -41.58 82.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.353 1.061 . . . . 0.0 111.61 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -65.29 -54.33 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 123.711 0.804 . . . . 0.0 110.398 175.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -58.19 -41.71 81.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.062 0.545 . . . . 0.0 111.147 -177.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -66.64 -46.58 75.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.486 0.714 . . . . 0.0 111.756 175.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -54.74 -56.36 20.06 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.806 0.73 . . . . 0.0 111.72 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m -60.23 -43.57 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -36.41 59.12 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.6 m -62.62 -40.05 95.74 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.112 0.965 . . . . 0.0 112.383 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -79.23 -18.8 52.15 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -44.3 96.66 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.321 0.964 . . . . 0.0 111.374 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -146.59 123.91 11.6 Favored 'General case' 0 C--N 1.338 0.077 0 C-N-CA 123.142 0.577 . . . . 0.0 111.757 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 61.5 m -91.16 14.81 13.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.979 1.311 . . . . 0.0 113.074 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -140.86 101.15 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.806 1.642 . . . . 0.0 111.117 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 116.807 -1.568 . . . . 0.0 110.506 172.264 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.069 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -93.25 -71.6 0.65 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 117.664 0.732 . . . . 0.0 110.198 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.23 -172.67 37.02 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.715 1.15 . . . . 0.0 113.071 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.9 p -115.07 77.3 1.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.185 1.794 . . . . 0.0 110.712 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.0 t -127.11 26.71 6.03 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.489 1.516 . . . . 0.0 112.542 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -86.25 156.17 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 121.441 0.638 . . . . 0.0 109.465 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -178.69 0.39 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.148 1.779 . . . . 0.0 112.128 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -85.66 -10.85 55.12 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.86 -1.15 . . . . 0.0 112.751 178.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.16 127.36 18.2 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 10.4 pt -49.77 -39.21 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.294 1.038 . . . . 0.0 112.875 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -56.72 -41.89 78.25 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.2 1.0 . . . . 0.0 111.897 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.7 -57.03 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 C-N-CA 124.06 0.944 . . . . 0.0 108.988 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.2 mm -59.29 -41.66 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.865 0.364 . . . . 0.0 111.764 -174.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -59.97 -51.3 70.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.481 0.713 . . . . 0.0 111.398 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.2 -41.42 71.96 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.738 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 94.2 t -58.24 -62.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 118.961 0.801 . . . . 0.0 110.267 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -27.62 66.51 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 p -51.92 -40.53 60.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.098 1.359 . . . . 0.0 112.598 -178.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -79.99 -41.34 26.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.35 1.06 . . . . 0.0 111.778 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -53.53 -65.66 0.53 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.412 1.085 . . . . 0.0 112.832 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 10.0 t 174.53 132.64 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.483 1.513 . . . . 0.0 110.415 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.1 t -78.63 127.39 32.05 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.178 0.991 . . . . 0.0 110.907 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.79 86.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.093 1.357 . . . . 0.0 109.543 178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.254 1.294 0 CA-C-O 116.805 -1.569 . . . . 0.0 113.372 173.092 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.574 HD13 HD21 ' A' ' 44' ' ' LEU . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.574 HD21 HD13 ' A' ' 41' ' ' LEU . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 69' ' ' VAL . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.586 HD21 HG11 ' A' ' 86' ' ' VAL . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 90' ' ' LEU . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.436 ' O ' HG22 ' A' ' 72' ' ' THR . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo . . . . . 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.586 HG11 HD21 ' A' ' 66' ' ' LEU . 24.9 m . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.661 ' O ' HD12 ' A' ' 91' ' ' ILE . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 67' ' ' ILE . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.661 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 54' ' ' LEU . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 53' ' ' ILE . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.684 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.476 ' O ' HG12 ' A' ' 69' ' ' VAL . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.51 HD11 HD21 ' A' ' 90' ' ' LEU . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 72' ' ' THR . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 65' ' ' THR . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 68' ' ' VAL . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.656 ' O ' HD12 ' A' ' 91' ' ' ILE . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.51 HD21 HD11 ' A' ' 67' ' ' ILE . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.401 ' HA ' HD23 ' A' ' 103' ' ' LEU . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 51' ' ' GLN . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' ILE . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.65 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo . . . . . 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.432 HG11 HD21 ' A' ' 66' ' ' LEU . 87.1 t . . . . . 0 N--CA 1.47 0.527 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.615 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' SER . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.435 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.495 ' HA ' HD12 ' A' ' 54' ' ' LEU . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 51' ' ' GLN . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.582 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.582 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.706 HD11 ' HB ' ' A' ' 86' ' ' VAL . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.706 ' HB ' HD11 ' A' ' 67' ' ' ILE . 24.0 m . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 91' ' ' ILE . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 87' ' ' SER . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.482 ' HA ' HD23 ' A' ' 97' ' ' LEU . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HA ' HD23 ' A' ' 44' ' ' LEU . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.622 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.487 ' HA ' HD12 ' A' ' 71' ' ' ILE . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 65' ' ' THR . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.54 ' HB2' HG21 ' A' ' 78' ' ' THR . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 68' ' ' VAL . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.54 HG21 ' HB2' ' A' ' 70' ' ' TRP . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo . . . . . 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 66' ' ' LEU . 34.2 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.417 HD11 ' HB1' ' A' ' 63' ' ' ALA . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.588 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.516 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.68 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 69' ' ' VAL . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 72' ' ' THR . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 65' ' ' THR . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 68' ' ' VAL . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 119.095 -0.479 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.501 ' O ' HD12 ' A' ' 91' ' ' ILE . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 87' ' ' SER . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.436 HD23 ' HE3' ' A' ' 100' ' ' LYS . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HE3' HD23 ' A' ' 97' ' ' LEU . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.43 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.43 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.465 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.465 HD12 ' O ' ' A' ' 49' ' ' VAL . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 71' ' ' ILE . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.0 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.57 ' HA ' HD12 ' A' ' 90' ' ' LEU . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 87' ' ' SER . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.473 ' HA ' HG12 ' A' ' 49' ' ' VAL . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.473 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.515 ' HA ' HD12 ' A' ' 54' ' ' LEU . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 51' ' ' GLN . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' ILE . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 91' ' ' ILE . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 49' ' ' VAL . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 51' ' ' GLN . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 90' ' ' LEU . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.729 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.44 HD11 HD12 ' A' ' 90' ' ' LEU . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.619 ' O ' HD12 ' A' ' 91' ' ' ILE . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 63' ' ' ALA . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.619 HD12 ' O ' ' A' ' 87' ' ' SER . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.634 HD13 HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.55 HD13 HD21 ' A' ' 90' ' ' LEU . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.522 ' O ' HG22 ' A' ' 72' ' ' THR . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.634 HG21 HD13 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HB ' HD11 ' A' ' 67' ' ' ILE . 15.2 m . . . . . 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.55 HD21 HD13 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.47 ' HA ' HD23 ' A' ' 103' ' ' LEU . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' HG12 ' A' ' 49' ' ' VAL . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.426 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' ILE . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.556 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.568 HD11 ' CG1' ' A' ' 86' ' ' VAL . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 72' ' ' THR . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.568 ' CG1' HD11 ' A' ' 67' ' ' ILE . 91.4 t . . . . . 0 N--CA 1.47 0.525 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.591 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 67' ' ' ILE . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.591 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 54' ' ' LEU . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.467 HD12 ' H ' ' A' ' 53' ' ' ILE . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.636 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 64' ' ' LEU . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.424 ' O ' HG22 ' A' ' 72' ' ' THR . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.233 -0.413 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.506 HD11 ' CB ' ' A' ' 63' ' ' ALA . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 97' ' ' LEU . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.419 ' HA ' HD23 ' A' ' 103' ' ' LEU . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.463 ' HA ' HD12 ' A' ' 54' ' ' LEU . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.504 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG12 ' A' ' 69' ' ' VAL . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 65' ' ' THR . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 N--CA 1.469 0.475 0 CA-C-O 119.056 -0.497 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.641 ' O ' HD12 ' A' ' 91' ' ' ILE . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 87' ' ' SER . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.544 ' HA ' HD23 ' A' ' 97' ' ' LEU . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.544 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.509 ' HA ' HD12 ' A' ' 54' ' ' LEU . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 53' ' ' ILE . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.526 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.526 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.765 HD11 HG13 ' A' ' 86' ' ' VAL . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.765 HG13 HD11 ' A' ' 67' ' ' ILE . 38.1 t . . . . . 0 N--CA 1.467 0.407 0 CA-C-O 118.732 -0.652 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 91' ' ' ILE . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.411 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.409 HD12 ' N ' ' A' ' 55' ' ' PHE . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.409 ' N ' HD12 ' A' ' 54' ' ' LEU . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.707 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.685 HD11 HG12 ' A' ' 86' ' ' VAL . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.685 HG12 HD11 ' A' ' 67' ' ' ILE . 5.4 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 119.487 -0.292 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.583 ' O ' HD12 ' A' ' 91' ' ' ILE . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' A' ' 63' ' ' ALA . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.583 HD12 ' O ' ' A' ' 87' ' ' SER . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 54' ' ' LEU . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.58 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 67' ' ' ILE . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 64' ' ' LEU . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.559 ' O ' HG22 ' A' ' 72' ' ' THR . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 68' ' ' VAL . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.624 ' HA ' HD23 ' A' ' 97' ' ' LEU . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.624 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 HG21 ' A' ' 48' ' ' THR . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 HD23 ' A' ' 44' ' ' LEU . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.504 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.449 ' O ' HG23 ' A' ' 57' ' ' VAL . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 53' ' ' ILE . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB1' HG13 ' A' ' 86' ' ' VAL . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 72' ' ' THR . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 66' ' ' LEU . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG13 ' HB1' ' A' ' 63' ' ' ALA . 59.0 t . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 118.742 -0.646 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.48 ' HA ' HD12 ' A' ' 54' ' ' LEU . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 49' ' ' VAL . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 51' ' ' GLN . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.587 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.587 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 86' ' ' VAL . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 72' ' ' THR . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo . . . . . 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.648 HG13 HD11 ' A' ' 67' ' ' ILE . 55.3 t . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.578 HD23 ' HE2' ' A' ' 100' ' ' LYS . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.578 ' HE2' HD23 ' A' ' 97' ' ' LEU . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.622 ' CD1' HD11 ' A' ' 90' ' ' LEU . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.412 ' O ' HG22 ' A' ' 72' ' ' THR . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 65' ' ' THR . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.587 ' O ' HD12 ' A' ' 91' ' ' ILE . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.622 HD11 ' CD1' ' A' ' 67' ' ' ILE . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.587 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.462 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.462 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.622 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 53' ' ' ILE . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.714 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.714 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.494 HG11 HD21 ' A' ' 66' ' ' LEU . 94.2 t . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 119.368 -0.348 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.632 ' O ' HD12 ' A' ' 91' ' ' ILE . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 87' ' ' SER . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.48 ' CE2' HD11 ' A' ' 102' ' ' LEU . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.485 ' HA ' HD23 ' A' ' 103' ' ' LEU . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.48 HD11 ' CE2' ' A' ' 98' ' ' TYR . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -106.84 -178.37 3.63 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.045 1.338 . . . . 0.0 110.46 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.98 161.24 19.16 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 121.753 0.641 . . . . 0.0 113.05 174.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 p -145.15 111.19 5.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.039 1.336 . . . . 0.0 110.027 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.5 t -91.94 14.68 15.01 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.187 1.395 . . . . 0.0 112.938 178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.9 mm -74.52 157.99 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.041 0.936 . . . . 0.0 109.905 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.59 158.97 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.033 1.333 . . . . 0.0 112.679 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -59.04 -16.5 18.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.574 HD13 HD21 ' A' ' 44' ' ' LEU . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.574 HD21 HD13 ' A' ' 41' ' ' LEU . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 69' ' ' VAL . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.586 HD21 HG11 ' A' ' 86' ' ' VAL . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 90' ' ' LEU . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.436 ' O ' HG22 ' A' ' 72' ' ' THR . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 82' ' ' ILE . 49.9 Cg_endo -66.86 152.12 81.04 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.9 pt -51.31 -39.24 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.155 0.982 . . . . 0.0 112.472 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -61.38 -41.06 96.49 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.252 1.021 . . . . 0.0 111.582 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.454 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.0 OUTLIER -63.78 -53.98 37.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 124.174 0.99 . . . . 0.0 109.328 176.303 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.02 -48.05 89.42 Favored 'Isoleucine or valine' 0 C--N 1.344 0.328 0 O-C-N 123.615 0.572 . . . . 0.0 110.307 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.93 -46.37 89.6 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.748 -0.595 . . . . 0.0 112.453 177.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -55.45 -58.82 6.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.17 0.988 . . . . 0.0 110.597 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.586 HG11 HD21 ' A' ' 66' ' ' LEU . 24.9 m -63.67 -42.29 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 -177.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.661 ' O ' HD12 ' A' ' 91' ' ' ILE . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 67' ' ' ILE . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.661 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.25 -30.08 69.04 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.3 t -51.92 -33.82 38.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.732 1.613 . . . . 0.0 112.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -81.42 -41.25 22.15 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -59.07 -68.6 0.26 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.365 1.066 . . . . 0.0 112.477 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 t 176.3 141.71 0.07 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.665 1.586 . . . . 0.0 110.242 -178.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.6 t -110.81 16.16 21.48 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.537 1.135 . . . . 0.0 112.855 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.97 106.14 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.307 1.843 . . . . 0.0 110.575 -177.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 C--O 1.262 1.721 0 CA-C-O 116.566 -1.683 . . . . 0.0 111.238 175.685 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -161.95 156.73 22.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.264 1.426 . . . . 0.0 110.451 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.75 -174.62 23.45 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.576 1.084 . . . . 0.0 111.99 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 m -138.35 149.14 45.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.844 1.658 . . . . 0.0 109.417 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t 47.51 30.14 1.57 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.412 1.485 . . . . 0.0 113.693 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.4 mm -75.35 151.59 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 123.936 0.894 . . . . 0.0 109.629 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.51 161.95 1.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.601 1.16 . . . . 0.0 112.87 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -61.98 -8.2 4.89 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 54' ' ' LEU . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 53' ' ' ILE . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.684 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.476 ' O ' HG12 ' A' ' 69' ' ' VAL . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.51 HD11 HD21 ' A' ' 90' ' ' LEU . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 72' ' ' THR . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 65' ' ' THR . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 68' ' ' VAL . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 HD11 ' A' ' 83' ' ' ILE . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 82' ' ' ILE . 56.2 Cg_endo -69.01 145.47 61.59 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.2 pt -49.28 -39.89 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 124.47 1.108 . . . . 0.0 112.57 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -44.07 96.35 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.712 1.205 . . . . 0.0 111.939 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 86' ' ' VAL . 7.7 mt -55.8 -56.89 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 109.139 173.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.811 HD11 HG21 ' A' ' 78' ' ' THR . 50.0 mm -60.99 -40.87 87.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 122.565 0.346 . . . . 0.0 111.776 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.49 -54.44 45.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.455 0.702 . . . . 0.0 110.763 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.47 -42.31 91.75 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.787 -0.625 . . . . 0.0 112.09 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 82' ' ' ILE . 70.5 t -55.14 -68.46 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 110.102 176.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.656 ' O ' HD12 ' A' ' 91' ' ' ILE . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.51 HD21 HD11 ' A' ' 67' ' ' ILE . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.401 ' HA ' HD23 ' A' ' 103' ' ' LEU . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -58.29 -34.8 70.93 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.5 m -56.76 -23.91 46.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.244 1.818 . . . . 0.0 113.164 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -106.14 -34.53 7.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.961 0.904 . . . . 0.0 112.53 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -61.13 -35.13 76.23 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.434 1.016 . . . . 0.0 112.847 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t -76.09 84.4 2.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.279 0.632 . . . . 0.0 111.695 176.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 58.3 m -128.12 84.1 2.21 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.822 1.249 . . . . 0.0 111.877 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 p -165.96 126.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.229 1.412 . . . . 0.0 109.377 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.3 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 117.155 -1.402 . . . . 0.0 110.276 172.555 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -164.68 176.02 9.23 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.494 1.518 . . . . 0.0 109.961 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.57 -161.21 12.88 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.982 1.277 . . . . 0.0 112.553 173.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.0 m -54.35 100.29 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.242 1.417 . . . . 0.0 112.005 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.8 t -121.34 23.32 10.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.305 1.842 . . . . 0.0 112.026 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.0 mp -128.99 163.33 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.264 1.426 . . . . 0.0 109.062 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.36 166.54 2.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.697 1.599 . . . . 0.0 112.124 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -62.63 -17.57 60.58 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 177.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 51' ' ' GLN . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' ILE . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.65 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.666 ' HB ' HD11 ' A' ' 83' ' ' ILE . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 82' ' ' ILE . 60.3 Cg_endo -67.11 153.92 76.07 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -47.62 -41.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 124.334 1.053 . . . . 0.0 112.041 176.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -63.07 -46.04 89.33 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.092 0.957 . . . . 0.0 112.553 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 86' ' ' VAL . 14.1 mt -58.14 -56.89 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 123.519 0.728 . . . . 0.0 109.503 172.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.666 HD11 ' HB ' ' A' ' 78' ' ' THR . 47.9 mm -62.66 -41.17 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.397 0.544 . . . . 0.0 112.253 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -56.79 -52.8 63.65 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.961 0.904 . . . . 0.0 110.11 174.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -57.66 -42.87 84.38 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 117.847 -1.073 . . . . 0.0 112.541 175.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 82' ' ' ILE . 87.1 t -54.78 -62.07 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 119.391 0.996 . . . . 0.0 110.174 176.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.615 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' SER . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.73 -27.98 62.37 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.3 t -51.65 -32.27 28.8 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.441 1.896 . . . . 0.0 112.815 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -84.52 -26.4 28.11 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -79.94 -56.77 4.02 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.052 1.341 . . . . 0.0 112.332 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.6 m -118.02 110.17 17.35 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.518 1.127 . . . . 0.0 110.456 -175.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.3 t -78.49 23.09 0.32 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.562 1.145 . . . . 0.0 113.827 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.2 t -131.69 87.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.993 2.117 . . . . 0.0 109.321 -175.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.538 1.535 . . . . 0.0 112.67 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 110.054 -1.218 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -143.05 166.36 24.85 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.437 1.095 . . . . 0.0 110.813 176.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.59 -144.29 5.58 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.815 0.721 . . . . 0.0 112.655 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -153.19 154.63 35.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.11 1.364 . . . . 0.0 108.98 172.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.5 t 44.03 34.51 0.96 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.708 1.603 . . . . 0.0 114.417 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.507 HD12 ' H ' ' A' ' 36' ' ' ILE . 2.5 mp -70.74 156.85 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 O-C-N 121.055 -1.028 . . . . 0.0 109.799 -176.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.12 160.73 1.98 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.792 1.237 . . . . 0.0 112.611 172.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -60.5 -16.64 38.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.265 1.026 . . . . 0.0 113.284 178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.435 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.495 ' HA ' HD12 ' A' ' 54' ' ' LEU . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 51' ' ' GLN . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.582 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.582 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.706 HD11 ' HB ' ' A' ' 86' ' ' VAL . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 82' ' ' ILE . 55.5 Cg_endo -69.5 153.69 69.79 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.0 pt -50.92 -39.13 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.401 1.081 . . . . 0.0 112.439 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -64.94 -36.47 84.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.346 1.058 . . . . 0.0 112.134 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.431 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.0 OUTLIER -65.92 -54.86 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.69 -43.13 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 O-C-N 123.367 0.417 . . . . 0.0 111.21 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.47 -44.52 94.21 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.263 1.025 . . . . 0.0 112.992 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -59.93 -57.63 12.06 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.863 0.756 . . . . 0.0 110.994 176.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.706 ' HB ' HD11 ' A' ' 67' ' ' ILE . 24.0 m -59.49 -45.83 93.42 Favored 'Isoleucine or valine' 0 C--N 1.342 0.274 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 91' ' ' ILE . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 87' ' ' SER . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.482 ' HA ' HD23 ' A' ' 97' ' ' LEU . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -34.51 71.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.9 t -53.32 -51.39 62.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.077 1.351 . . . . 0.0 111.289 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -70.38 -28.61 65.24 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -62.36 -26.9 68.71 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.4 t -118.94 -167.38 1.38 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.443 1.097 . . . . 0.0 112.351 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 16.4 t -101.02 119.75 39.19 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.131 0.972 . . . . 0.0 110.957 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.8 p -163.49 128.64 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 126.34 1.856 . . . . 0.0 108.87 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 115.968 -1.967 . . . . 0.0 110.368 171.841 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.354 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -142.67 113.43 7.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.562 1.545 . . . . 0.0 109.292 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.1 167.21 31.49 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.55 0.595 . . . . 0.0 113.247 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.1 m -110.13 84.4 1.92 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.231 1.413 . . . . 0.0 110.291 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.1 t -138.9 31.52 2.22 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.091 1.757 . . . . 0.0 112.025 -178.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.22 152.95 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 124.32 1.048 . . . . 0.0 109.703 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.98 171.5 3.5 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.168 1.787 . . . . 0.0 112.017 174.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -66.3 -17.46 64.77 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HA ' HD23 ' A' ' 44' ' ' LEU . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.622 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.487 ' HA ' HD12 ' A' ' 71' ' ' ILE . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 65' ' ' THR . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.54 ' HB2' HG21 ' A' ' 78' ' ' THR . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 68' ' ' VAL . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.54 HG21 ' HB2' ' A' ' 70' ' ' TRP . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.32 151.98 71.59 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.4 pt -51.03 -38.27 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.488 1.115 . . . . 0.0 112.774 176.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.63 -41.69 97.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.085 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 86' ' ' VAL . 1.5 mt -60.43 -54.56 33.39 Favored 'Isoleucine or valine' 0 C--N 1.345 0.394 0 C-N-CA 123.864 0.866 . . . . 0.0 108.931 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD13 HD11 ' A' ' 66' ' ' LEU . 45.9 mm -63.18 -41.62 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.098 0.559 . . . . 0.0 111.479 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -67.05 -46.08 75.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.244 0.618 . . . . 0.0 111.806 177.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.23 -58.46 8.12 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.501 1.121 . . . . 0.0 111.456 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 66' ' ' LEU . 34.2 m -60.55 -42.05 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.417 HD11 ' HB1' ' A' ' 63' ' ' ALA . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.588 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.93 -31.46 71.79 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.8 t -52.27 -43.59 64.48 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.898 1.679 . . . . 0.0 112.419 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -74.26 -41.66 60.9 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.308 0.504 . . . . 0.0 111.621 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -57.65 -39.99 78.3 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.9 t -72.38 79.3 1.02 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 111.191 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -107.77 159.49 16.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.331 1.452 . . . . 0.0 112.346 174.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -162.12 132.32 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 126.804 2.042 . . . . 0.0 108.166 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . 0.266 14.7 t . . . . . 0 C--O 1.256 1.411 0 CA-C-O 114.752 -2.546 . . . . 0.0 111.421 173.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 108.856 -1.698 . . . . 0.0 108.856 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -153.73 149.34 27.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.465 1.132 . . . . 0.0 109.625 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.89 171.02 47.34 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.141 0.876 . . . . 0.0 113.457 -176.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 m -123.46 148.78 45.85 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.488 1.515 . . . . 0.0 109.699 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t 46.91 32.81 1.96 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.607 1.563 . . . . 0.0 114.041 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.8 mm -76.71 146.77 8.24 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.406 -0.809 . . . . 0.0 109.871 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.55 161.03 2.89 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.386 1.474 . . . . 0.0 112.794 174.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -66.87 -18.49 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.769 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.516 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.68 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 69' ' ' VAL . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 72' ' ' THR . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 65' ' ' THR . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 68' ' ' VAL . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.77 145.31 62.53 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.4 pt -48.09 -40.68 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -46.18 89.13 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.745 1.218 . . . . 0.0 111.762 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.465 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.8 mt -55.75 -55.93 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.554 0.742 . . . . 0.0 109.432 173.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.5 mm -61.8 -38.81 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -57.81 -57.48 12.58 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.758 0.823 . . . . 0.0 110.051 176.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -55.75 -42.17 75.01 Favored 'General case' 0 C--N 1.344 0.345 0 C-N-CA 123.937 0.895 . . . . 0.0 111.851 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 82' ' ' ILE . 74.1 t -57.03 -69.6 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.413 1.085 . . . . 0.0 110.435 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.501 ' O ' HD12 ' A' ' 91' ' ' ILE . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 87' ' ' SER . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.436 HD23 ' HE3' ' A' ' 100' ' ' LYS . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HE3' HD23 ' A' ' 97' ' ' LEU . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.43 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.43 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -72.72 -31.91 65.33 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.7 p -58.03 -40.18 80.22 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.833 0.853 . . . . 0.0 112.328 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.09 -32.61 50.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.454 1.102 . . . . 0.0 112.703 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.06 -22.98 67.23 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 175.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t -117.08 178.23 4.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 112.119 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.0 m -81.72 94.6 7.03 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.317 -0.864 . . . . 0.0 110.096 174.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.4 t -132.15 90.68 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.162 0.985 . . . . 0.0 110.383 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.708 1.603 . . . . 0.0 111.591 175.028 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 CA-C-O 118.431 -1.205 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -146.25 120.55 9.59 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.07 1.348 . . . . 0.0 109.646 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.83 102.18 0.08 OUTLIER Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.366 0.984 . . . . 0.0 113.725 175.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 p -141.99 118.43 10.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.241 1.016 . . . . 0.0 110.441 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -101.04 18.84 18.68 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.485 1.514 . . . . 0.0 112.124 177.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 20.8 mm -73.8 150.32 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 O-C-N 121.294 -0.879 . . . . 0.0 109.206 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.89 173.45 0.6 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.772 1.629 . . . . 0.0 113.063 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -69.59 -8.27 45.89 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 120.64 -1.288 . . . . 0.0 113.957 177.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.465 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.465 HD12 ' O ' ' A' ' 49' ' ' VAL . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 71' ' ' ILE . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -68.18 126.32 14.22 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.8 pt -48.64 -39.37 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.677 1.191 . . . . 0.0 112.906 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -56.8 -44.3 81.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.497 1.119 . . . . 0.0 111.156 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.573 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.1 mm -61.93 -59.33 4.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.206 0 C-N-CA 123.948 0.899 . . . . 0.0 110.053 175.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.6 mm -57.1 -41.51 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 122.736 0.414 . . . . 0.0 111.403 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -60.83 -51.0 71.17 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.979 0.912 . . . . 0.0 111.878 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -53.61 -45.94 70.24 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.739 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 82' ' ' ILE . 18.0 t -54.72 -59.35 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.219 0.608 . . . . 0.0 110.099 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.57 ' HA ' HD12 ' A' ' 90' ' ' LEU . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 87' ' ' SER . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -63.58 -31.59 72.8 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -52.57 -49.01 65.82 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.868 1.267 . . . . 0.0 111.038 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -62.56 -40.3 96.42 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -57.77 -27.67 63.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 113.153 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.9 t -131.99 54.8 1.91 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.036 0.935 . . . . 0.0 111.66 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 p -105.02 141.19 37.03 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.983 0.913 . . . . 0.0 111.239 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.53 106.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 126.687 1.995 . . . . 0.0 110.277 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 C--O 1.254 1.342 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.51 176.245 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.335 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -159.71 151.55 20.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.084 1.754 . . . . 0.0 109.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.78 -167.49 6.77 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 123.589 0.614 . . . . 0.0 114.28 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -123.5 76.04 1.38 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.287 1.435 . . . . 0.0 110.819 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.0 t -118.03 26.47 9.63 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.997 1.719 . . . . 0.0 112.372 -177.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -105.01 155.22 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 109.593 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.55 175.69 1.01 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.805 1.642 . . . . 0.0 112.287 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -78.52 -11.41 59.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.759 -1.213 . . . . 0.0 113.698 175.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.473 ' HA ' HG12 ' A' ' 49' ' ' VAL . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.473 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.515 ' HA ' HD12 ' A' ' 54' ' ' LEU . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 51' ' ' GLN . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' ILE . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.95 145.72 62.83 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 20.8 pt -49.01 -40.15 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.692 1.197 . . . . 0.0 112.554 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.03 -41.81 97.29 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.523 1.129 . . . . 0.0 111.876 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.578 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.1 mt -58.72 -56.97 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 123.559 0.744 . . . . 0.0 109.552 171.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.6 mm -60.05 -43.59 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.017 0.527 . . . . 0.0 112.263 -173.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -59.26 -48.82 80.19 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.753 0.821 . . . . 0.0 110.805 177.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -48.94 74.09 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.343 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 82' ' ' ILE . 21.6 t -52.56 -55.5 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 118.529 0.604 . . . . 0.0 109.765 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 91' ' ' ILE . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -36.58 80.24 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.6 p -55.61 -39.24 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.093 1.357 . . . . 0.0 113.161 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -72.11 -46.69 55.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.798 0.839 . . . . 0.0 110.752 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -56.17 -52.18 65.3 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.883 0.873 . . . . 0.0 112.668 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.2 t -152.05 147.02 25.99 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.424 . . . . 0.0 111.013 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.9 t -135.61 103.75 5.55 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.58 0.752 . . . . 0.0 111.124 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -163.01 124.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.19 1.396 . . . . 0.0 109.914 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.0 m . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.65 1.58 . . . . 0.0 111.263 173.097 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.127 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -148.21 162.95 38.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.306 1.443 . . . . 0.0 109.467 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.69 161.38 17.13 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 125.182 1.372 . . . . 0.0 110.53 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.2 t -151.49 158.61 43.86 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.243 1.417 . . . . 0.0 109.189 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.4 t 47.32 26.66 0.76 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.854 1.662 . . . . 0.0 114.093 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.5 mm -70.94 153.36 8.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 120.794 -1.191 . . . . 0.0 109.34 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.91 160.12 1.02 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.432 1.493 . . . . 0.0 112.285 172.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -63.52 -13.44 41.2 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 49' ' ' VAL . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 51' ' ' GLN . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 90' ' ' LEU . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.729 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.44 HD11 HD12 ' A' ' 90' ' ' LEU . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.555 ' CE3' HG21 ' A' ' 83' ' ' ILE . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.12 151.98 76.75 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -43.9 -44.74 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 125.404 1.482 . . . . 0.0 114.0 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -56.99 -48.09 79.26 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.853 0.861 . . . . 0.0 112.243 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.4 ' O ' HG22 ' A' ' 86' ' ' VAL . 1.1 mp -64.64 -40.75 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 C-N-CA 124.237 1.015 . . . . 0.0 109.686 176.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.648 HD12 HD11 ' A' ' 66' ' ' LEU . 41.0 mm -64.89 -34.31 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 119.244 0.929 . . . . 0.0 112.404 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -72.75 -51.28 19.77 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.364 -0.835 . . . . 0.0 112.21 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -47.0 85.71 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.394 -0.812 . . . . 0.0 111.868 176.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 82' ' ' ILE . 29.1 m -63.16 -46.1 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 119.321 0.964 . . . . 0.0 111.059 177.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.619 ' O ' HD12 ' A' ' 91' ' ' ILE . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 63' ' ' ALA . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.619 HD12 ' O ' ' A' ' 87' ' ' SER . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -62.3 -31.05 71.6 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.0 m -54.33 -36.22 63.53 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.225 1.41 . . . . 0.0 112.583 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -77.57 -48.06 17.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.504 0.593 . . . . 0.0 111.891 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -59.37 -61.35 2.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.777 0.831 . . . . 0.0 113.061 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.2 m -68.82 -65.55 0.69 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.385 0.674 . . . . 0.0 110.137 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 t 59.58 13.57 3.43 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.7 m -134.37 106.66 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 126.961 2.104 . . . . 0.0 110.486 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.998 -1.477 . . . . 0.0 111.379 172.947 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 CA-C-O 118.746 -1.03 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -170.22 -178.64 2.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.592 1.557 . . . . 0.0 109.55 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.04 -176.7 8.32 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.259 0.933 . . . . 0.0 113.986 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.0 p -105.4 93.14 4.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.829 2.052 . . . . 0.0 110.679 -172.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.8 t -135.24 25.51 3.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.954 1.301 . . . . 0.0 112.408 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -87.02 155.62 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 121.578 0.704 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.6 171.79 1.87 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.907 1.283 . . . . 0.0 111.606 175.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -60.76 -12.71 11.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.634 HD13 HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.55 HD13 HD21 ' A' ' 90' ' ' LEU . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.522 ' O ' HG22 ' A' ' 72' ' ' THR . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.634 HG21 HD13 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG2' HD13 ' A' ' 82' ' ' ILE . 53.3 Cg_endo -69.96 152.38 68.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.7 pt -51.31 -39.7 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.414 1.086 . . . . 0.0 112.534 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -41.25 95.37 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.108 0.963 . . . . 0.0 111.576 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.474 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.1 mp -63.59 -52.51 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 124.863 1.265 . . . . 0.0 108.987 174.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.5 mm -62.23 -31.26 50.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 118.831 0.742 . . . . 0.0 111.832 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -67.36 -58.5 4.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.236 1.014 . . . . 0.0 112.505 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.35 -46.31 83.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.839 0.456 . . . . 0.0 111.429 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HB ' HD11 ' A' ' 67' ' ' ILE . 15.2 m -64.0 -47.67 89.42 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 178.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.55 HD21 HD13 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.47 ' HA ' HD23 ' A' ' 103' ' ' LEU . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -66.95 -31.64 72.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -51.83 -39.69 59.23 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.85 1.26 . . . . 0.0 112.432 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.14 -37.74 45.37 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -56.94 -52.45 65.16 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.538 0.735 . . . . 0.0 111.761 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.4 t -162.71 138.09 6.95 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.0 0.52 . . . . 0.0 111.089 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.4 t -119.25 15.05 13.09 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.631 1.172 . . . . 0.0 112.093 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -167.81 121.06 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.92 2.088 . . . . 0.0 110.957 -175.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 125.257 1.423 . . . . 0.0 112.037 175.171 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.417 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -121.81 -63.17 1.33 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.024 0.93 . . . . 0.0 111.283 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.83 156.75 27.91 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.513 1.054 . . . . 0.0 112.43 -174.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.0 m -129.06 82.33 2.08 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.542 1.137 . . . . 0.0 109.541 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 36' ' ' ILE . 6.4 t -132.72 30.0 4.11 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.725 1.61 . . . . 0.0 111.685 -174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.41 HD12 ' H ' ' A' ' 35' ' ' THR . 2.8 mp -109.92 154.14 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.383 1.473 . . . . 0.0 109.859 -177.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.42 160.4 2.36 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.048 1.739 . . . . 0.0 113.124 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -63.4 -13.55 40.93 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' HG12 ' A' ' 49' ' ' VAL . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.426 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' ILE . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.556 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.568 HD11 ' CG1' ' A' ' 86' ' ' VAL . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 72' ' ' THR . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.419 ' HG2' HD13 ' A' ' 82' ' ' ILE . 56.1 Cg_endo -66.58 150.87 83.8 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 11.1 pt -47.4 -44.1 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.208 1.003 . . . . 0.0 111.97 177.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -56.7 -45.16 81.97 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.581 1.152 . . . . 0.0 113.009 178.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.523 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -59.66 -54.7 30.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.7 mm -61.75 -44.89 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.535 0.607 . . . . 0.0 112.069 -175.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -55.54 -50.66 69.43 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.386 1.074 . . . . 0.0 111.723 174.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -56.8 -49.0 76.68 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.264 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.568 ' CG1' HD11 ' A' ' 67' ' ' ILE . 91.4 t -51.31 -57.27 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 123.799 0.84 . . . . 0.0 110.482 179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.591 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 67' ' ' ILE . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.591 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -28.65 67.72 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -59.93 -57.54 12.44 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.751 1.22 . . . . 0.0 112.478 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -74.8 -6.22 47.77 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.56 -174.19 0.84 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.567 1.547 . . . . 0.0 111.423 170.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 9.7 t -49.85 94.27 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.512 1.525 . . . . 0.0 113.509 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.1 m -99.15 6.88 46.26 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.805 1.242 . . . . 0.0 112.609 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -163.09 125.8 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 126.923 2.089 . . . . 0.0 109.386 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 115.778 -2.058 . . . . 0.0 113.102 175.431 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.743 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -65.89 104.67 1.14 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.004 1.402 . . . . 0.0 110.657 -178.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -161.85 -48.81 0.02 OUTLIER Glycine 0 CA--C 1.531 1.088 0 N-CA-C 114.939 0.736 . . . . 0.0 114.939 -178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 t -145.01 161.55 39.12 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.382 1.073 . . . . 0.0 110.518 173.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.2 t 43.0 31.75 0.36 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.942 1.697 . . . . 0.0 113.881 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.511 HD12 ' H ' ' A' ' 36' ' ' ILE . 1.7 mp -70.48 157.93 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 121.049 -1.032 . . . . 0.0 109.364 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.18 161.85 1.19 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.849 1.659 . . . . 0.0 112.227 172.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -59.53 -14.86 14.63 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 54' ' ' LEU . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.467 HD12 ' H ' ' A' ' 53' ' ' ILE . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.636 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 64' ' ' LEU . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.424 ' O ' HG22 ' A' ' 72' ' ' THR . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.428 ' HG2' HD13 ' A' ' 82' ' ' ILE . 56.6 Cg_endo -66.18 151.19 84.2 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.3 pt -47.65 -45.09 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.517 1.127 . . . . 0.0 111.93 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -55.53 -45.53 77.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.027 1.331 . . . . 0.0 112.927 177.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.596 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -60.83 -53.76 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 176.278 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.9 mm -60.04 -47.84 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.139 0.427 . . . . 0.0 111.55 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -57.74 -45.04 86.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.722 0.809 . . . . 0.0 111.623 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -55.75 -51.97 65.53 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-O 117.881 -1.056 . . . . 0.0 111.641 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 82' ' ' ILE . 21.4 t -50.76 -54.8 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.826 0.739 . . . . 0.0 109.977 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.506 HD11 ' CB ' ' A' ' 63' ' ' ALA . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 97' ' ' LEU . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.419 ' HA ' HD23 ' A' ' 103' ' ' LEU . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -62.73 -35.69 80.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -52.06 -34.8 45.1 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.678 1.591 . . . . 0.0 112.594 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.59 -41.15 18.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.32 -52.3 66.23 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.632 0.773 . . . . 0.0 113.033 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 t -168.64 152.42 5.62 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.34 0.656 . . . . 0.0 111.2 175.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 76.6 p -97.11 145.38 26.05 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.73 -0.606 . . . . 0.0 111.496 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.37 104.93 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.168 1.387 . . . . 0.0 109.739 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.63 -1.652 . . . . 0.0 110.872 169.902 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -152.5 139.84 19.49 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.628 1.171 . . . . 0.0 109.581 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.72 173.59 13.0 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.63 1.586 . . . . 0.0 112.309 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -142.74 166.99 23.13 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.483 1.913 . . . . 0.0 109.624 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.4 t 44.76 29.89 0.48 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.522 1.529 . . . . 0.0 114.553 -177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.541 HD12 ' H ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -68.66 157.67 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 123.385 0.674 . . . . 0.0 109.43 -176.423 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.27 164.91 1.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.493 1.517 . . . . 0.0 112.074 175.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -83.22 -9.23 59.26 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.258 -0.901 . . . . 0.0 113.303 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.463 ' HA ' HD12 ' A' ' 54' ' ' LEU . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.504 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG12 ' A' ' 69' ' ' VAL . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 65' ' ' THR . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.04 112.42 2.5 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.5 pt -45.08 -37.69 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.752 1.621 . . . . 0.0 113.602 176.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -55.54 -52.17 64.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.04 1.336 . . . . 0.0 111.473 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.589 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.6 mp -58.09 -52.01 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 124.66 1.184 . . . . 0.0 109.408 175.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.1 mm -57.16 -45.74 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.084 0.402 . . . . 0.0 111.286 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -59.88 -47.73 84.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.836 0.854 . . . . 0.0 111.999 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -54.99 -46.03 75.11 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.827 173.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 82' ' ' ILE . 14.7 t -55.77 -56.09 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 123.082 0.553 . . . . 0.0 109.758 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.641 ' O ' HD12 ' A' ' 91' ' ' ILE . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 87' ' ' SER . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.544 ' HA ' HD23 ' A' ' 97' ' ' LEU . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.544 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -36.09 83.25 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.3 m -65.86 -46.5 78.23 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.352 1.061 . . . . 0.0 112.213 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -59.46 -35.44 74.07 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -59.85 -38.99 83.7 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.4 t -164.75 119.2 1.35 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.713 0.688 . . . . 0.0 111.685 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 77.6 p -120.75 159.91 24.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.236 1.415 . . . . 0.0 112.004 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.0 m -143.03 119.55 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 126.148 1.779 . . . . 0.0 109.927 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.238 0 C-N-CA 126.879 2.072 . . . . 0.0 112.54 170.655 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.182 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -76.8 -179.87 5.67 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.595 0.758 . . . . 0.0 112.344 175.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.5 99.67 0.13 Allowed Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.822 1.201 . . . . 0.0 111.928 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -143.23 153.83 43.21 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.292 1.437 . . . . 0.0 110.319 173.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t 43.5 33.29 0.62 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 126.55 1.94 . . . . 0.0 113.605 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 36' ' ' ILE . 1.7 mp -70.97 155.71 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.093 -1.004 . . . . 0.0 109.711 -176.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.74 156.45 3.61 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 125.79 1.636 . . . . 0.0 112.007 173.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -63.04 -12.5 26.73 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.509 ' HA ' HD12 ' A' ' 54' ' ' LEU . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 53' ' ' ILE . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.526 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.526 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.765 HD11 HG13 ' A' ' 86' ' ' VAL . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.444 ' OG1' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.441 ' HG2' HD13 ' A' ' 82' ' ' ILE . 58.2 Cg_endo -68.47 153.15 74.47 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.1 pt -49.1 -40.28 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 124.469 1.108 . . . . 0.0 112.779 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -59.99 -46.7 88.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.607 1.163 . . . . 0.0 112.61 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.441 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.1 mp -59.41 -50.74 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.369 1.068 . . . . 0.0 109.471 176.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.444 HD11 ' OG1' ' A' ' 78' ' ' THR . 47.6 mm -64.8 -38.42 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.857 -0.527 . . . . 0.0 111.514 -178.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.23 -63.02 1.29 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 110.404 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -54.86 -43.68 73.33 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.394 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.765 HG13 HD11 ' A' ' 67' ' ' ILE . 38.1 t -56.65 -67.81 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.992 1.317 . . . . 0.0 110.618 178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 91' ' ' ILE . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.62 -57.16 9.84 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.0 p -62.52 -23.83 67.17 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.132 0.973 . . . . 0.0 112.983 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -99.38 11.92 37.78 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.83 1.652 . . . . 0.0 112.515 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -86.29 -57.94 2.82 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.122 0.874 . . . . 0.0 111.852 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.8 t -75.62 68.13 2.19 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.911 1.284 . . . . 0.0 110.514 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 t -160.9 136.63 8.08 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.673 0.789 . . . . 0.0 111.126 175.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 47.4 t -136.69 90.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 125.226 1.41 . . . . 0.0 108.739 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.624 -1.655 . . . . 0.0 111.342 175.066 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.448 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -81.81 -39.56 23.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.49 173.46 21.72 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.773 1.177 . . . . 0.0 112.595 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 m -131.46 80.8 1.95 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.145 1.378 . . . . 0.0 110.449 -175.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.409 ' H ' HD12 ' A' ' 36' ' ' ILE . 11.3 t -129.35 36.23 4.16 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.527 1.931 . . . . 0.0 111.222 -177.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 35' ' ' THR . 2.5 mp -131.42 156.37 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.651 1.18 . . . . 0.0 108.737 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.0 163.1 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.44 1.896 . . . . 0.0 111.948 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -62.07 -10.64 10.68 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.411 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.409 HD12 ' N ' ' A' ' 55' ' ' PHE . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.409 ' N ' HD12 ' A' ' 54' ' ' LEU . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.707 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.685 HD11 HG12 ' A' ' 86' ' ' VAL . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.25 129.1 21.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.8 pt -47.98 -40.43 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.99 1.316 . . . . 0.0 112.584 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -47.33 76.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.821 1.648 . . . . 0.0 111.586 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 86' ' ' VAL . 11.9 mm -60.29 -58.93 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.083 0.953 . . . . 0.0 109.764 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.44 -41.78 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 CA-C-N 118.281 0.491 . . . . 0.0 111.555 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.12 -56.39 22.67 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.554 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -50.45 -43.84 55.33 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.133 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.685 HG12 HD11 ' A' ' 67' ' ' ILE . 5.4 t -59.22 -61.13 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 118.913 0.779 . . . . 0.0 110.736 177.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.583 ' O ' HD12 ' A' ' 91' ' ' ILE . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' A' ' 63' ' ' ALA . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.583 HD12 ' O ' ' A' ' 87' ' ' SER . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 -38.64 10.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.0 t -62.28 -33.75 75.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.796 1.238 . . . . 0.0 112.133 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -70.22 -37.1 74.95 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -62.69 -59.62 4.64 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.778 0.717 . . . . 0.0 112.21 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.6 t -139.34 129.38 25.09 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.629 1.172 . . . . 0.0 109.092 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 7.1 t -101.36 166.49 10.72 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.33 1.052 . . . . 0.0 111.076 175.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 p -167.77 123.48 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 126.375 1.87 . . . . 0.0 109.249 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 116.688 -1.625 . . . . 0.0 110.225 173.119 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 m120 63.34 31.65 15.12 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.426 1.09 . . . . 0.0 112.859 174.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.53 -164.23 27.88 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 124.871 1.224 . . . . 0.0 112.671 -173.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.5 m -134.99 87.62 2.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.63 1.572 . . . . 0.0 109.085 176.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.0 t -124.31 26.44 7.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.806 1.642 . . . . 0.0 111.42 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -118.44 150.77 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.533 1.533 . . . . 0.0 109.25 -177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.33 168.54 1.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.755 2.022 . . . . 0.0 112.327 174.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -68.78 -15.85 63.63 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 54' ' ' LEU . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.58 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 67' ' ' ILE . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 64' ' ' LEU . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.559 ' O ' HG22 ' A' ' 72' ' ' THR . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 68' ' ' VAL . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.63 113.82 2.87 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.4 pt -47.87 -34.16 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.173 1.389 . . . . 0.0 113.833 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.56 -49.27 76.93 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.468 1.107 . . . . 0.0 111.178 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mt -59.73 -52.34 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.616 1.167 . . . . 0.0 110.12 172.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.4 mm -58.06 -42.64 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.609 0.64 . . . . 0.0 111.021 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -64.56 -48.72 73.97 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.538 0.735 . . . . 0.0 112.809 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -56.02 -55.67 30.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.354 0.525 . . . . 0.0 111.83 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m -63.05 -42.57 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.624 ' HA ' HD23 ' A' ' 97' ' ' LEU . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.624 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.14 -34.63 78.47 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.5 m -58.91 -18.18 31.01 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.643 1.577 . . . . 0.0 113.755 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -102.95 -27.84 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.75 -44.2 74.24 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 176.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 88.3 p -138.52 -178.07 5.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 110.482 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 69.4 m 62.88 19.82 11.79 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.8 m -138.49 105.31 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.59 1.956 . . . . 0.0 110.439 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.039 173.414 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.218 0 CA-C-O 117.953 -1.471 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -141.3 139.71 33.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.559 1.18 . . . . 0.0 108.514 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.74 -177.74 39.42 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.276 0.941 . . . . 0.0 112.821 175.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.8 t -114.57 86.59 2.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.0 0.92 . . . . 0.0 110.719 -176.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.1 t -128.1 30.63 5.2 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.052 1.741 . . . . 0.0 112.609 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.86 154.31 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.648 1.179 . . . . 0.0 109.196 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.02 173.75 1.77 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.116 1.366 . . . . 0.0 111.699 174.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -68.6 -16.24 63.79 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 HG21 ' A' ' 48' ' ' THR . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 HD23 ' A' ' 44' ' ' LEU . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.504 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.449 ' O ' HG23 ' A' ' 57' ' ' VAL . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 53' ' ' ILE . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB1' HG13 ' A' ' 86' ' ' VAL . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 72' ' ' THR . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 66' ' ' LEU . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.54 131.53 21.73 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 16.5 pt -49.92 -42.68 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.548 1.139 . . . . 0.0 112.292 175.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -41.88 70.73 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.224 1.41 . . . . 0.0 112.4 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' HG23 ' A' ' 86' ' ' VAL . 11.4 mm -63.21 -60.15 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.684 0.794 . . . . 0.0 109.487 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.0 mm -57.17 -40.94 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.745 0.702 . . . . 0.0 111.955 -174.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -57.96 -54.9 41.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.08 0.952 . . . . 0.0 111.882 173.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -54.62 -40.21 68.69 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.251 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG13 ' HB1' ' A' ' 63' ' ' ALA . 59.0 t -59.47 -67.06 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 124.142 0.977 . . . . 0.0 110.841 177.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -48.33 68.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.3 m -62.46 -21.63 65.6 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.828 0.851 . . . . 0.0 112.728 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -89.6 -34.88 16.16 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.108 0.963 . . . . 0.0 112.381 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.57 -64.67 0.87 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.981 1.312 . . . . 0.0 112.671 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -77.07 77.65 3.61 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.181 0.593 . . . . 0.0 110.644 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 62.8 m -73.13 116.96 14.28 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.39 1.076 . . . . 0.0 111.777 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.22 94.24 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.836 1.254 . . . . 0.0 109.626 176.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.82 1.648 . . . . 0.0 112.493 169.994 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.23 172.25 13.19 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.067 1.747 . . . . 0.0 110.001 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.32 161.01 38.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.375 0.512 . . . . 0.0 113.375 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.9 m -100.99 75.41 1.67 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.443 1.097 . . . . 0.0 111.188 -174.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t -139.75 35.5 1.99 Allowed 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.369 1.08 . . . . 0.0 112.494 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -99.64 155.08 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.199 -0.938 . . . . 0.0 109.079 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.01 175.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.323 1.849 . . . . 0.0 112.111 174.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -68.94 -15.02 63.38 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.18 -1.575 . . . . 0.0 114.135 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.48 ' HA ' HD12 ' A' ' 54' ' ' LEU . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 49' ' ' VAL . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 51' ' ' GLN . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.587 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.587 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 86' ' ' VAL . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 72' ' ' THR . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.799 HG21 HD11 ' A' ' 83' ' ' ILE . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -68.22 145.5 66.54 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -49.12 -41.09 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.138 0.975 . . . . 0.0 112.344 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -60.17 -42.1 94.25 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.337 1.055 . . . . 0.0 112.305 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.456 HG23 HD21 ' A' ' 66' ' ' LEU . 6.4 mt -58.79 -55.17 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.961 0.904 . . . . 0.0 109.734 172.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.799 HD11 HG21 ' A' ' 78' ' ' THR . 49.4 mm -63.82 -34.02 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.776 -0.577 . . . . 0.0 111.682 -175.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.09 -61.92 2.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.478 1.111 . . . . 0.0 110.337 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -57.14 -37.89 72.71 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-O 118.453 -0.784 . . . . 0.0 112.131 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.648 HG13 HD11 ' A' ' 67' ' ' ILE . 55.3 t -58.21 -63.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.118 0.967 . . . . 0.0 110.142 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.578 HD23 ' HE2' ' A' ' 100' ' ' LYS . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.578 ' HE2' HD23 ' A' ' 97' ' ' LEU . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -36.16 82.84 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 41.6 t -60.47 -49.5 77.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.35 1.46 . . . . 0.0 111.151 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -61.58 -43.19 99.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -59.71 -33.13 71.21 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 m -104.95 76.89 1.28 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.631 1.572 . . . . 0.0 112.172 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.56 14.5 11.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.225 1.01 . . . . 0.0 113.417 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.2 p -167.86 123.76 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.099 2.16 . . . . 0.0 109.082 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 116.671 -1.633 . . . . 0.0 110.278 171.782 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 CA-C-O 119.237 -0.757 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -158.84 113.01 2.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.186 0.994 . . . . 0.0 110.908 170.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -172.62 175.64 45.67 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.221 0.915 . . . . 0.0 112.725 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.9 p -111.68 71.65 0.75 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.224 1.81 . . . . 0.0 111.285 -173.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.3 t -129.18 27.91 5.32 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.846 1.258 . . . . 0.0 112.91 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.2 mm -72.61 157.08 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.593 0.711 . . . . 0.0 110.398 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.1 157.44 6.01 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.481 1.913 . . . . 0.0 112.321 174.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -64.26 -16.74 62.69 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.622 ' CD1' HD11 ' A' ' 90' ' ' LEU . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.412 ' O ' HG22 ' A' ' 72' ' ' THR . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 65' ' ' THR . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.65 128.92 19.96 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 18.5 pt -48.83 -37.99 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.524 1.13 . . . . 0.0 112.768 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.78 -41.58 82.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.353 1.061 . . . . 0.0 111.61 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -65.29 -54.33 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 123.711 0.804 . . . . 0.0 110.398 175.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -58.19 -41.71 81.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.062 0.545 . . . . 0.0 111.147 -177.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -66.64 -46.58 75.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.486 0.714 . . . . 0.0 111.756 175.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -54.74 -56.36 20.06 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.806 0.73 . . . . 0.0 111.72 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m -60.23 -43.57 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.587 ' O ' HD12 ' A' ' 91' ' ' ILE . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.622 HD11 ' CD1' ' A' ' 67' ' ' ILE . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.587 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -76.03 -36.41 59.12 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.6 m -62.62 -40.05 95.74 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.112 0.965 . . . . 0.0 112.383 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -79.23 -18.8 52.15 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -44.3 96.66 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.321 0.964 . . . . 0.0 111.374 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -146.59 123.91 11.6 Favored 'General case' 0 C--N 1.338 0.077 0 C-N-CA 123.142 0.577 . . . . 0.0 111.757 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 61.5 m -91.16 14.81 13.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.979 1.311 . . . . 0.0 113.074 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -140.86 101.15 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.806 1.642 . . . . 0.0 111.117 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 116.807 -1.568 . . . . 0.0 110.506 172.264 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.069 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -93.25 -71.6 0.65 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 117.664 0.732 . . . . 0.0 110.198 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.23 -172.67 37.02 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.715 1.15 . . . . 0.0 113.071 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.9 p -115.07 77.3 1.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.185 1.794 . . . . 0.0 110.712 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.0 t -127.11 26.71 6.03 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.489 1.516 . . . . 0.0 112.542 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -86.25 156.17 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 121.441 0.638 . . . . 0.0 109.465 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -178.69 0.39 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.148 1.779 . . . . 0.0 112.128 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -85.66 -10.85 55.12 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.86 -1.15 . . . . 0.0 112.751 178.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.462 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.462 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.622 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 53' ' ' ILE . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.714 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.714 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.475 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 82' ' ' ILE . 37.2 Cg_endo -65.16 127.36 18.2 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 10.4 pt -49.77 -39.21 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.294 1.038 . . . . 0.0 112.875 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -56.72 -41.89 78.25 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.2 1.0 . . . . 0.0 111.897 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.553 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.6 mp -63.7 -57.03 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 C-N-CA 124.06 0.944 . . . . 0.0 108.988 175.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.475 HG21 ' CZ2' ' A' ' 70' ' ' TRP . 37.2 mm -59.29 -41.66 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.865 0.364 . . . . 0.0 111.764 -174.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -59.97 -51.3 70.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.481 0.713 . . . . 0.0 111.398 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.2 -41.42 71.96 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.738 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 82' ' ' ILE . 94.2 t -58.24 -62.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 118.961 0.801 . . . . 0.0 110.267 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.632 ' O ' HD12 ' A' ' 91' ' ' ILE . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 87' ' ' SER . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.48 ' CE2' HD11 ' A' ' 102' ' ' LEU . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.485 ' HA ' HD23 ' A' ' 103' ' ' LEU . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.48 HD11 ' CE2' ' A' ' 98' ' ' TYR . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -59.64 -27.62 66.51 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 p -51.92 -40.53 60.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.098 1.359 . . . . 0.0 112.598 -178.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -79.99 -41.34 26.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.35 1.06 . . . . 0.0 111.778 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -53.53 -65.66 0.53 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.412 1.085 . . . . 0.0 112.832 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 10.0 t 174.53 132.64 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.483 1.513 . . . . 0.0 110.415 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.1 t -78.63 127.39 32.05 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.178 0.991 . . . . 0.0 110.907 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.79 86.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.093 1.357 . . . . 0.0 109.543 178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.254 1.294 0 CA-C-O 116.805 -1.569 . . . . 0.0 113.372 173.092 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.574 HD13 HD21 ' A' ' 44' ' ' LEU . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.574 HD21 HD13 ' A' ' 41' ' ' LEU . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 69' ' ' VAL . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.586 HD21 HG11 ' A' ' 86' ' ' VAL . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 90' ' ' LEU . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.436 ' O ' HG22 ' A' ' 72' ' ' THR . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo . . . . . 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.586 HG11 HD21 ' A' ' 66' ' ' LEU . 24.9 m . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.661 ' O ' HD12 ' A' ' 91' ' ' ILE . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 67' ' ' ILE . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.661 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 54' ' ' LEU . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 53' ' ' ILE . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.684 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.476 ' O ' HG12 ' A' ' 69' ' ' VAL . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.51 HD11 HD21 ' A' ' 90' ' ' LEU . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 72' ' ' THR . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 65' ' ' THR . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 68' ' ' VAL . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.576 -0.726 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.656 ' O ' HD12 ' A' ' 91' ' ' ILE . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.51 HD21 HD11 ' A' ' 67' ' ' ILE . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.401 ' HA ' HD23 ' A' ' 103' ' ' LEU . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 51' ' ' GLN . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' ILE . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.65 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo . . . . . 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.432 HG11 HD21 ' A' ' 66' ' ' LEU . 87.1 t . . . . . 0 N--CA 1.47 0.527 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.615 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' SER . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.435 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.495 ' HA ' HD12 ' A' ' 54' ' ' LEU . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 51' ' ' GLN . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.582 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.582 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.706 HD11 ' HB ' ' A' ' 86' ' ' VAL . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.706 ' HB ' HD11 ' A' ' 67' ' ' ILE . 24.0 m . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 91' ' ' ILE . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 87' ' ' SER . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.482 ' HA ' HD23 ' A' ' 97' ' ' LEU . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HA ' HD23 ' A' ' 44' ' ' LEU . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.622 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.487 ' HA ' HD12 ' A' ' 71' ' ' ILE . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 65' ' ' THR . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.54 ' HB2' HG21 ' A' ' 78' ' ' THR . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 68' ' ' VAL . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.54 HG21 ' HB2' ' A' ' 70' ' ' TRP . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo . . . . . 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 66' ' ' LEU . 34.2 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.417 HD11 ' HB1' ' A' ' 63' ' ' ALA . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.588 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.516 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.68 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 69' ' ' VAL . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 72' ' ' THR . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 65' ' ' THR . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 68' ' ' VAL . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 119.095 -0.479 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.501 ' O ' HD12 ' A' ' 91' ' ' ILE . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 87' ' ' SER . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.436 HD23 ' HE3' ' A' ' 100' ' ' LYS . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HE3' HD23 ' A' ' 97' ' ' LEU . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.43 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.43 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.465 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.465 HD12 ' O ' ' A' ' 49' ' ' VAL . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 71' ' ' ILE . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.0 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.57 ' HA ' HD12 ' A' ' 90' ' ' LEU . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 87' ' ' SER . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.473 ' HA ' HG12 ' A' ' 49' ' ' VAL . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.473 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.515 ' HA ' HD12 ' A' ' 54' ' ' LEU . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 51' ' ' GLN . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' ILE . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 91' ' ' ILE . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 49' ' ' VAL . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 51' ' ' GLN . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 90' ' ' LEU . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.729 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.44 HD11 HD12 ' A' ' 90' ' ' LEU . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.619 ' O ' HD12 ' A' ' 91' ' ' ILE . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 63' ' ' ALA . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.619 HD12 ' O ' ' A' ' 87' ' ' SER . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.634 HD13 HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.55 HD13 HD21 ' A' ' 90' ' ' LEU . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.522 ' O ' HG22 ' A' ' 72' ' ' THR . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.634 HG21 HD13 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HB ' HD11 ' A' ' 67' ' ' ILE . 15.2 m . . . . . 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.55 HD21 HD13 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.47 ' HA ' HD23 ' A' ' 103' ' ' LEU . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' HG12 ' A' ' 49' ' ' VAL . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.426 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' ILE . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.556 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.568 HD11 ' CG1' ' A' ' 86' ' ' VAL . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 72' ' ' THR . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.568 ' CG1' HD11 ' A' ' 67' ' ' ILE . 91.4 t . . . . . 0 N--CA 1.47 0.525 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.591 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 67' ' ' ILE . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.591 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 54' ' ' LEU . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.467 HD12 ' H ' ' A' ' 53' ' ' ILE . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.636 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 64' ' ' LEU . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.424 ' O ' HG22 ' A' ' 72' ' ' THR . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.233 -0.413 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.506 HD11 ' CB ' ' A' ' 63' ' ' ALA . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 97' ' ' LEU . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.419 ' HA ' HD23 ' A' ' 103' ' ' LEU . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.463 ' HA ' HD12 ' A' ' 54' ' ' LEU . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.504 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG12 ' A' ' 69' ' ' VAL . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 65' ' ' THR . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 N--CA 1.469 0.475 0 CA-C-O 119.056 -0.497 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.641 ' O ' HD12 ' A' ' 91' ' ' ILE . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 87' ' ' SER . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.544 ' HA ' HD23 ' A' ' 97' ' ' LEU . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.544 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.509 ' HA ' HD12 ' A' ' 54' ' ' LEU . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 53' ' ' ILE . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.526 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.526 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.765 HD11 HG13 ' A' ' 86' ' ' VAL . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.765 HG13 HD11 ' A' ' 67' ' ' ILE . 38.1 t . . . . . 0 N--CA 1.467 0.407 0 CA-C-O 118.732 -0.652 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 91' ' ' ILE . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.411 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.409 HD12 ' N ' ' A' ' 55' ' ' PHE . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.409 ' N ' HD12 ' A' ' 54' ' ' LEU . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.707 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.685 HD11 HG12 ' A' ' 86' ' ' VAL . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.685 HG12 HD11 ' A' ' 67' ' ' ILE . 5.4 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 119.487 -0.292 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.583 ' O ' HD12 ' A' ' 91' ' ' ILE . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' A' ' 63' ' ' ALA . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.583 HD12 ' O ' ' A' ' 87' ' ' SER . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 54' ' ' LEU . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.58 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 67' ' ' ILE . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 64' ' ' LEU . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.559 ' O ' HG22 ' A' ' 72' ' ' THR . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 68' ' ' VAL . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.624 ' HA ' HD23 ' A' ' 97' ' ' LEU . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.624 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 HG21 ' A' ' 48' ' ' THR . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 HD23 ' A' ' 44' ' ' LEU . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.504 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.449 ' O ' HG23 ' A' ' 57' ' ' VAL . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 53' ' ' ILE . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB1' HG13 ' A' ' 86' ' ' VAL . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 72' ' ' THR . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 66' ' ' LEU . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG13 ' HB1' ' A' ' 63' ' ' ALA . 59.0 t . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 118.742 -0.646 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.48 ' HA ' HD12 ' A' ' 54' ' ' LEU . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 49' ' ' VAL . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 51' ' ' GLN . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.587 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.587 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 86' ' ' VAL . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 72' ' ' THR . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo . . . . . 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.648 HG13 HD11 ' A' ' 67' ' ' ILE . 55.3 t . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.578 HD23 ' HE2' ' A' ' 100' ' ' LYS . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.578 ' HE2' HD23 ' A' ' 97' ' ' LEU . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.622 ' CD1' HD11 ' A' ' 90' ' ' LEU . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.412 ' O ' HG22 ' A' ' 72' ' ' THR . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 65' ' ' THR . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.587 ' O ' HD12 ' A' ' 91' ' ' ILE . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.622 HD11 ' CD1' ' A' ' 67' ' ' ILE . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.587 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.462 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.462 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.622 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 53' ' ' ILE . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.714 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.714 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.494 HG11 HD21 ' A' ' 66' ' ' LEU . 94.2 t . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 119.368 -0.348 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.632 ' O ' HD12 ' A' ' 91' ' ' ILE . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 87' ' ' SER . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.48 ' CE2' HD11 ' A' ' 102' ' ' LEU . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.485 ' HA ' HD23 ' A' ' 103' ' ' LEU . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.48 HD11 ' CE2' ' A' ' 98' ' ' TYR . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -106.84 -178.37 3.63 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.045 1.338 . . . . 0.0 110.46 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.98 161.24 19.16 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 121.753 0.641 . . . . 0.0 113.05 174.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 p -145.15 111.19 5.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.039 1.336 . . . . 0.0 110.027 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.5 t -91.94 14.68 15.01 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.187 1.395 . . . . 0.0 112.938 178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.9 mm -74.52 157.99 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.041 0.936 . . . . 0.0 109.905 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.59 158.97 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.033 1.333 . . . . 0.0 112.679 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -59.04 -16.5 18.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.44 -39.64 16.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.911 2.084 . . . . 0.0 112.655 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.12 -49.51 77.35 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 0.0 111.177 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.574 HD13 HD21 ' A' ' 44' ' ' LEU . 4.6 mm? -61.22 -44.49 97.19 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.938 0.895 . . . . 0.0 110.085 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -58.79 -35.61 73.11 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.202 0.91 . . . . 0.0 112.512 175.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -69.89 -58.96 5.85 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 121.552 -0.718 . . . . 0.0 111.832 174.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.574 HD21 HD13 ' A' ' 41' ' ' LEU . 3.7 pp -61.11 -34.1 74.43 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.8 1.3 . . . . 0.0 112.43 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 p -74.35 -27.83 22.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 119.609 1.095 . . . . 0.0 112.057 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -103.1 4.75 37.42 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.984 0.914 . . . . 0.0 113.102 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.5 m -136.34 -46.25 0.62 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.825 1.25 . . . . 0.0 112.729 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m -84.74 -50.8 7.29 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.0 0.92 . . . . 0.0 110.716 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.98 -44.67 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.821 176.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -47.95 -41.2 24.32 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.779 1.172 . . . . 0.0 111.21 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.11 -39.21 89.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.851 0.86 . . . . 0.0 112.48 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.45 84.9 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.045 1.338 . . . . 0.0 111.848 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -59.52 -56.68 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.543 0.737 . . . . 0.0 109.672 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.29 -49.99 72.68 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.946 0.899 . . . . 0.0 110.773 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.72 -51.45 68.78 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 125.305 1.442 . . . . 0.0 111.235 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -53.27 -45.75 64.19 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.357 -0.69 . . . . 0.0 113.279 175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -60.61 -63.57 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.171 0.988 . . . . 0.0 110.91 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -55.63 -41.25 73.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.824 0.45 . . . . 0.0 111.69 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.5 t -66.09 -50.55 63.71 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.067 0.947 . . . . 0.0 111.884 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.85 -43.84 98.77 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-N 118.155 0.434 . . . . 0.0 112.228 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.68 -49.02 79.35 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.394 0.597 . . . . 0.0 112.132 174.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.2 83.21 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.826 0.85 . . . . 0.0 112.269 175.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.06 -51.98 67.44 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.885 -0.509 . . . . 0.0 111.854 171.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 tt -54.18 -52.92 59.67 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 69' ' ' VAL . 8.9 t -59.4 -40.39 86.48 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.107 0.412 . . . . 0.0 111.469 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.586 HD21 HG11 ' A' ' 86' ' ' VAL . 0.2 OUTLIER -64.73 -39.34 93.47 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.302 0.956 . . . . 0.0 111.624 177.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 90' ' ' LEU . 34.5 mt -58.57 -57.97 8.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.99 0.916 . . . . 0.0 109.007 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.436 ' O ' HG22 ' A' ' 72' ' ' THR . 24.6 m -56.31 -44.65 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.13 178.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 71.3 t -53.54 -49.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.153 0.888 . . . . 0.0 110.763 177.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 18.5 t-105 -60.84 -37.43 82.04 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.158 0.89 . . . . 0.0 112.727 176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.28 -41.84 94.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 124.079 0.952 . . . . 0.0 112.098 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -102.85 -63.85 1.13 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.295 1.038 . . . . 0.0 112.708 -175.559 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.7 t -57.58 -24.56 56.93 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.29 1.436 . . . . 0.0 112.342 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 51.55 31.31 7.44 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.606 1.563 . . . . 0.0 112.518 176.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 m -54.64 163.09 0.99 Allowed 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.451 1.501 . . . . 0.0 111.27 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -45.61 130.02 8.88 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.297 0.639 . . . . 0.0 111.114 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -43.22 115.59 0.78 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.109 1.364 . . . . 0.0 110.003 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.84 154.28 68.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.34 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 82' ' ' ILE . 49.9 Cg_endo -66.86 152.12 81.04 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 121.804 1.67 . . . . 0.0 110.936 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.9 pt -51.31 -39.24 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.155 0.982 . . . . 0.0 112.472 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -61.38 -41.06 96.49 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.252 1.021 . . . . 0.0 111.582 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.454 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.0 OUTLIER -63.78 -53.98 37.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 124.174 0.99 . . . . 0.0 109.328 176.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.02 -48.05 89.42 Favored 'Isoleucine or valine' 0 C--N 1.344 0.328 0 O-C-N 123.615 0.572 . . . . 0.0 110.307 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.93 -46.37 89.6 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.748 -0.595 . . . . 0.0 112.453 177.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -55.45 -58.82 6.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.17 0.988 . . . . 0.0 110.597 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.586 HG11 HD21 ' A' ' 66' ' ' LEU . 24.9 m -63.67 -42.29 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.732 -177.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.661 ' O ' HD12 ' A' ' 91' ' ' ILE . 16.3 m -53.87 -57.77 9.72 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.124 0.969 . . . . 0.0 111.303 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.1 mt -53.97 -52.07 61.87 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.3 0.5 . . . . 0.0 111.042 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -55.02 -44.51 74.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 67' ' ' ILE . 54.2 mt -56.99 -55.08 39.32 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.654 1.581 . . . . 0.0 112.147 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.661 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -62.26 -52.77 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.41 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 58.2 mt -54.77 -43.94 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.045 0.938 . . . . 0.0 110.692 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.61 -59.64 4.44 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.554 1.142 . . . . 0.0 110.877 171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -55.45 -49.12 73.29 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.337 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.2 m -58.29 -48.02 81.8 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.121 0.873 . . . . 0.0 112.31 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.97 83.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.335 0.654 . . . . 0.0 112.083 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -39.2 79.51 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.142 0.577 . . . . 0.0 110.934 174.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -64.4 -50.97 65.51 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.163 0.892 . . . . 0.0 110.544 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -57.99 -49.24 77.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.473 -0.299 . . . . 0.0 111.614 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -34.92 78.45 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -67.25 -44.73 78.69 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.884 1.274 . . . . 0.0 111.608 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 75.1 mt -67.57 -45.73 74.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 117.866 0.303 . . . . 0.0 111.587 175.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.25 -30.08 69.04 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.3 t -51.92 -33.82 38.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.732 1.613 . . . . 0.0 112.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -81.42 -41.25 22.15 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -59.07 -68.6 0.26 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.365 1.066 . . . . 0.0 112.477 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 t 176.3 141.71 0.07 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.665 1.586 . . . . 0.0 110.242 -178.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.6 t -110.81 16.16 21.48 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.537 1.135 . . . . 0.0 112.855 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.97 106.14 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.307 1.843 . . . . 0.0 110.575 -177.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 C--O 1.262 1.721 0 CA-C-O 116.566 -1.683 . . . . 0.0 111.238 175.685 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -161.95 156.73 22.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.264 1.426 . . . . 0.0 110.451 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.75 -174.62 23.45 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.576 1.084 . . . . 0.0 111.99 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 m -138.35 149.14 45.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.844 1.658 . . . . 0.0 109.417 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t 47.51 30.14 1.57 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.412 1.485 . . . . 0.0 113.693 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.4 mm -75.35 151.59 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 123.936 0.894 . . . . 0.0 109.629 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.51 161.95 1.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.601 1.16 . . . . 0.0 112.87 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -61.98 -8.2 4.89 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -52.26 -35.1 49.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.433 1.493 . . . . 0.0 111.932 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.1 -48.65 80.7 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.249 0.62 . . . . 0.0 111.688 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.3 mm? -64.0 -52.96 57.11 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.806 1.242 . . . . 0.0 109.925 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -56.47 -37.62 70.58 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.927 0.491 . . . . 0.0 111.03 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -65.73 -48.82 63.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.463 1.03 . . . . 0.0 113.311 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.14 -39.02 74.38 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.461 1.13 . . . . 0.0 112.008 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -82.82 -24.61 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -57.11 -50.33 73.12 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.968 0.907 . . . . 0.0 111.281 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.0 p -169.26 49.17 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 m -132.27 -59.09 0.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.187 -1.57 . . . . 0.0 110.884 177.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -40.27 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.037 0.535 . . . . 0.0 111.383 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 t -62.7 -32.94 74.13 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.517 0.727 . . . . 0.0 111.348 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 54' ' ' LEU . 6.5 tp60 -70.17 -31.17 68.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.508 0.723 . . . . 0.0 111.53 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.8 88.98 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.57 1.148 . . . . 0.0 112.105 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.1 mp -58.58 -52.02 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 123.981 0.913 . . . . 0.0 109.809 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.0 mt -56.17 -53.01 62.2 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.331 1.052 . . . . 0.0 110.365 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -55.99 -50.15 71.66 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.779 1.232 . . . . 0.0 111.343 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.32 -49.44 60.13 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 119.246 -0.752 . . . . 0.0 112.44 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 53' ' ' ILE . 86.0 t -57.86 -60.78 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.354 1.077 . . . . 0.0 111.593 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -56.78 -40.78 76.48 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.881 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.1 t -59.72 -50.7 72.83 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.268 1.027 . . . . 0.0 111.413 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.17 -53.49 42.34 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 119.09 0.859 . . . . 0.0 112.965 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.72 -48.81 73.28 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.33 -39.07 85.76 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.633 0.773 . . . . 0.0 111.727 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.684 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.01 -51.54 66.43 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.723 0.809 . . . . 0.0 111.53 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.97 -52.6 40.99 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.275 0.63 . . . . 0.0 111.989 176.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.476 ' O ' HG12 ' A' ' 69' ' ' VAL . 13.0 t -61.42 -38.58 87.66 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.064 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.19 -34.24 77.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.409 1.004 . . . . 0.0 112.157 175.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.51 HD11 HD21 ' A' ' 90' ' ' LEU . 22.3 mt -71.21 -55.37 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 121.315 -0.865 . . . . 0.0 109.682 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 72' ' ' THR . 32.8 m -55.82 -46.43 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.193 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 65' ' ' THR . 14.4 p -60.16 -45.48 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.931 0.893 . . . . 0.0 111.338 175.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -36.29 75.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.818 1.19 . . . . 0.0 113.188 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.66 -61.94 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.627 0.771 . . . . 0.0 110.111 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 68' ' ' VAL . 15.2 t -63.51 -44.34 94.58 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -174.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.2 t -76.73 -8.33 57.07 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.366 1.066 . . . . 0.0 112.769 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 42.87 60.89 2.3 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 127.214 2.205 . . . . 0.0 112.011 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.69 166.54 1.33 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.49 -1.232 . . . . 0.0 112.458 -178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -56.34 166.06 0.93 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.767 0.794 . . . . 0.0 111.522 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -50.54 118.68 3.21 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 124.306 1.042 . . . . 0.0 110.905 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 HD11 ' A' ' 83' ' ' ILE . 15.4 t -92.89 138.46 23.43 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.104 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 82' ' ' ILE . 56.2 Cg_endo -69.01 145.47 61.59 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 111.202 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.2 pt -49.28 -39.89 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 124.47 1.108 . . . . 0.0 112.57 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -44.07 96.35 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.712 1.205 . . . . 0.0 111.939 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 86' ' ' VAL . 7.7 mt -55.8 -56.89 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 109.139 173.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.811 HD11 HG21 ' A' ' 78' ' ' THR . 50.0 mm -60.99 -40.87 87.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 122.565 0.346 . . . . 0.0 111.776 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.49 -54.44 45.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.455 0.702 . . . . 0.0 110.763 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.47 -42.31 91.75 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.787 -0.625 . . . . 0.0 112.09 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 82' ' ' ILE . 70.5 t -55.14 -68.46 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 110.102 176.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.656 ' O ' HD12 ' A' ' 91' ' ' ILE . 52.6 m -53.11 -50.01 65.34 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.059 0.845 . . . . 0.0 111.384 -175.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.1 mt -47.35 -49.93 23.31 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.576 0.75 . . . . 0.0 112.191 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.11 -51.76 60.84 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.51 HD21 HD11 ' A' ' 67' ' ' ILE . 3.5 mm? -56.18 -44.64 79.56 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.78 0.718 . . . . 0.0 111.973 -178.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -61.84 -48.53 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.3 mt -55.11 -43.07 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.459 0.704 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.2 -58.07 10.26 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.654 0.782 . . . . 0.0 111.211 175.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -57.08 -45.12 83.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.46 0.573 . . . . 0.0 111.658 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.3 t -59.01 -56.23 24.91 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.098 0.959 . . . . 0.0 111.211 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.33 -44.66 96.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 112.535 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.6 mt -59.0 -60.76 3.35 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.083 0.953 . . . . 0.0 111.165 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -58.52 -44.56 89.59 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.497 0.719 . . . . 0.0 110.919 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.63 -56.08 17.92 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.129 0.972 . . . . 0.0 112.178 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.401 ' HA ' HD23 ' A' ' 103' ' ' LEU . 9.6 mtpm? -60.84 -45.46 94.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.797 -0.62 . . . . 0.0 111.044 176.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -55.65 -37.19 67.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.106 0.963 . . . . 0.0 112.81 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.5 mt -68.32 -56.6 8.0 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.764 0.826 . . . . 0.0 111.867 171.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -58.29 -34.8 70.93 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.899 -0.501 . . . . 0.0 111.934 -177.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.5 m -56.76 -23.91 46.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.244 1.818 . . . . 0.0 113.164 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -106.14 -34.53 7.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.961 0.904 . . . . 0.0 112.53 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -61.13 -35.13 76.23 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.434 1.016 . . . . 0.0 112.847 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t -76.09 84.4 2.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.279 0.632 . . . . 0.0 111.695 176.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 58.3 m -128.12 84.1 2.21 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.822 1.249 . . . . 0.0 111.877 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 p -165.96 126.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.229 1.412 . . . . 0.0 109.377 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.3 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 117.155 -1.402 . . . . 0.0 110.276 172.555 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -164.68 176.02 9.23 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.494 1.518 . . . . 0.0 109.961 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.57 -161.21 12.88 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.982 1.277 . . . . 0.0 112.553 173.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.0 m -54.35 100.29 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.242 1.417 . . . . 0.0 112.005 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.8 t -121.34 23.32 10.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.305 1.842 . . . . 0.0 112.026 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.0 mp -128.99 163.33 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.264 1.426 . . . . 0.0 109.062 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.36 166.54 2.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.697 1.599 . . . . 0.0 112.124 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -62.63 -17.57 60.58 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 177.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -49.86 -37.3 30.27 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.558 1.543 . . . . 0.0 112.861 177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.84 -49.4 77.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.496 0.718 . . . . 0.0 111.713 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.58 -50.78 71.24 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.319 1.048 . . . . 0.0 109.828 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -56.12 -41.25 74.99 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.106 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.69 -53.32 47.15 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.363 1.458 . . . . 0.0 113.296 174.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.43 -39.26 82.95 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 117.996 0.898 . . . . 0.0 111.861 -178.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.9 m -80.57 -23.98 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 O-C-N 121.682 -0.636 . . . . 0.0 112.417 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -50.96 71.59 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.704 1.201 . . . . 0.0 111.143 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -170.01 64.61 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.215 1.006 . . . . 0.0 110.443 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -148.02 -57.37 0.23 Allowed 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.549 -1.344 . . . . 0.0 110.713 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 p -70.17 -46.14 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.302 0.501 . . . . 0.0 111.301 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -61.04 -37.71 83.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.69 0.796 . . . . 0.0 111.268 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -65.18 -31.19 72.23 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.683 0.793 . . . . 0.0 112.241 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.95 -48.65 80.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.963 0.905 . . . . 0.0 111.747 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.7 mp -57.85 -53.71 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.652 0.781 . . . . 0.0 109.871 176.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 51' ' ' GLN . 23.4 mt -54.7 -49.76 69.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.026 0.931 . . . . 0.0 111.08 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -61.14 -47.9 84.11 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.686 1.194 . . . . 0.0 112.097 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.65 -43.55 94.31 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 123.845 0.736 . . . . 0.0 112.765 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' ILE . 96.1 t -59.39 -64.82 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.232 1.013 . . . . 0.0 110.484 177.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -58.34 -34.62 70.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.315 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.5 m -60.82 -62.33 1.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.224 1.01 . . . . 0.0 111.922 175.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.54 -41.91 97.45 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.0 0.363 . . . . 0.0 112.625 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.45 -51.34 69.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.44 0.696 . . . . 0.0 112.734 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.51 82.44 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 124.001 0.92 . . . . 0.0 111.477 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.65 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -60.16 -53.48 57.25 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.79 -54.09 26.44 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.325 0.65 . . . . 0.0 111.921 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -60.1 -40.51 89.87 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.41 -44.75 80.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.365 1.066 . . . . 0.0 111.396 174.733 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 25.3 mt -62.56 -47.02 94.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.81 -56.85 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.889 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.27 -39.65 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 118.905 0.775 . . . . 0.0 111.117 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 37.8 t90 -67.48 -37.74 83.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 119.316 0.962 . . . . 0.0 113.244 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.7 mt -60.93 -41.08 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 119.702 1.137 . . . . 0.0 111.648 176.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t -87.3 -49.47 7.23 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.4 t -74.46 -27.07 60.42 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.24 1.016 . . . . 0.0 113.218 -177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 57.6 44.96 20.04 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.606 1.562 . . . . 0.0 112.047 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -47.91 114.82 0.99 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.888 1.275 . . . . 0.0 113.003 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -68.28 -5.91 21.06 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -91.24 13.06 18.22 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.405 1.882 . . . . 0.0 114.231 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.666 ' HB ' HD11 ' A' ' 83' ' ' ILE . 10.9 p -111.21 78.78 1.87 Allowed Pre-proline 0 N--CA 1.468 0.454 0 C-N-CA 125.166 1.386 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 82' ' ' ILE . 60.3 Cg_endo -67.11 153.92 76.07 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.171 1.914 . . . . 0.0 110.416 174.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -47.62 -41.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 124.334 1.053 . . . . 0.0 112.041 176.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -63.07 -46.04 89.33 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.092 0.957 . . . . 0.0 112.553 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 86' ' ' VAL . 14.1 mt -58.14 -56.89 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 123.519 0.728 . . . . 0.0 109.503 172.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.666 HD11 ' HB ' ' A' ' 78' ' ' THR . 47.9 mm -62.66 -41.17 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.397 0.544 . . . . 0.0 112.253 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -56.79 -52.8 63.65 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.961 0.904 . . . . 0.0 110.11 174.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -57.66 -42.87 84.38 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 117.847 -1.073 . . . . 0.0 112.541 175.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 82' ' ' ILE . 87.1 t -54.78 -62.07 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 119.391 0.996 . . . . 0.0 110.174 176.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.615 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -59.21 -50.52 73.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.154 -177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 27.9 mt -53.02 -54.19 39.0 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.514 0.726 . . . . 0.0 111.507 177.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -50.6 -46.22 57.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.196 0.998 . . . . 0.0 112.229 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' SER . 17.5 mt -56.04 -53.23 59.44 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.734 0.814 . . . . 0.0 112.216 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -65.98 -43.51 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 122.964 0.505 . . . . 0.0 111.336 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.8 mt -60.02 -44.8 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.831 0.852 . . . . 0.0 109.757 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp -55.19 -57.45 11.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.797 1.239 . . . . 0.0 111.237 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.86 -49.04 79.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.693 0.678 . . . . 0.0 112.147 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.8 p -61.3 -49.81 75.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.014 0.925 . . . . 0.0 112.23 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.35 84.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.746 0.703 . . . . 0.0 112.768 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.01 -58.76 7.24 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.548 0.739 . . . . 0.0 111.425 173.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -59.41 -39.51 83.69 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.428 0.104 . . . . 0.0 111.112 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -55.48 -58.25 8.55 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.84 0.856 . . . . 0.0 112.382 174.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -31.99 70.53 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 119.471 -0.3 . . . . 0.0 111.794 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.23 -41.81 80.7 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 112.258 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.31 -43.61 85.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.77 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.73 -27.98 62.37 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 118.573 -0.727 . . . . 0.0 112.921 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.3 t -51.65 -32.27 28.8 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.441 1.896 . . . . 0.0 112.815 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -84.52 -26.4 28.11 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -79.94 -56.77 4.02 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.052 1.341 . . . . 0.0 112.332 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.6 m -118.02 110.17 17.35 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.518 1.127 . . . . 0.0 110.456 -175.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.3 t -78.49 23.09 0.32 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.562 1.145 . . . . 0.0 113.827 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.2 t -131.69 87.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.993 2.117 . . . . 0.0 109.321 -175.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.538 1.535 . . . . 0.0 112.67 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 110.054 -1.218 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -143.05 166.36 24.85 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.437 1.095 . . . . 0.0 110.813 176.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.59 -144.29 5.58 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.815 0.721 . . . . 0.0 112.655 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -153.19 154.63 35.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.11 1.364 . . . . 0.0 108.98 172.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.5 t 44.03 34.51 0.96 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.708 1.603 . . . . 0.0 114.417 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.507 HD12 ' H ' ' A' ' 36' ' ' ILE . 2.5 mp -70.74 156.85 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 O-C-N 121.055 -1.028 . . . . 0.0 109.799 -176.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.12 160.73 1.98 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.792 1.237 . . . . 0.0 112.611 172.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -60.5 -16.64 38.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.265 1.026 . . . . 0.0 113.284 178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -46.78 -38.23 9.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.979 2.112 . . . . 0.0 112.904 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -58.48 -57.69 11.84 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.067 0.547 . . . . 0.0 110.435 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.61 -38.35 74.79 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.562 1.145 . . . . 0.0 111.851 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -56.49 -64.66 0.8 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.52 0.512 . . . . 0.0 110.551 175.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.45 -34.79 82.56 Favored Glycine 0 CA--C 1.537 1.421 0 CA-C-N 118.015 0.371 . . . . 0.0 113.266 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 6.6 mt -54.17 -67.44 0.26 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.662 1.585 . . . . 0.0 112.325 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.435 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.0 p -71.06 -24.78 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -55.94 -57.24 12.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.146 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -159.51 34.9 0.19 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -173.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 82.9 m -127.96 -59.8 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.802 0.841 . . . . 0.0 110.884 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -63.01 -39.66 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 118.793 0.724 . . . . 0.0 111.488 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 t -63.54 -35.22 79.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.198 0.999 . . . . 0.0 111.401 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.495 ' HA ' HD12 ' A' ' 54' ' ' LEU . 14.1 tt0 -64.88 -31.73 73.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.575 0.75 . . . . 0.0 111.627 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.56 98.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.307 1.043 . . . . 0.0 112.764 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.57 -50.01 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.789 0.836 . . . . 0.0 109.57 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 51' ' ' GLN . 13.4 mt -59.16 -53.39 58.86 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.44 1.096 . . . . 0.0 110.744 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -56.32 -52.56 64.09 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.175 0.99 . . . . 0.0 110.552 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.3 94.41 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.137 0.875 . . . . 0.0 113.333 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.56 -60.38 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-N 118.343 1.072 . . . . 0.0 110.618 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -63.51 -39.82 95.42 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.246 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.8 t -55.18 -54.93 37.12 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.121 1.368 . . . . 0.0 111.509 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.34 -46.61 93.98 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.929 0.786 . . . . 0.0 113.383 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.61 64.72 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 117.485 0.642 . . . . 0.0 112.126 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.45 89.4 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.04 0.936 . . . . 0.0 111.899 177.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.582 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -57.16 -55.74 30.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.106 0.962 . . . . 0.0 111.521 171.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -51.19 -53.0 38.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 112.135 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -60.29 -41.88 94.3 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 118.392 -0.814 . . . . 0.0 111.783 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.582 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -60.74 -39.53 89.02 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.106 1.321 . . . . 0.0 111.392 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.706 HD11 ' HB ' ' A' ' 86' ' ' VAL . 18.0 mt -63.53 -56.81 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.868 0.867 . . . . 0.0 109.444 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -61.73 -35.65 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.095 -0.479 . . . . 0.0 111.302 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.5 t -59.88 -55.85 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 125.224 1.41 . . . . 0.0 110.989 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -59.49 -36.61 76.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.222 0.919 . . . . 0.0 112.083 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.03 -54.04 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.837 0.855 . . . . 0.0 111.207 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.1 t -77.62 -46.83 20.9 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.473 0.579 . . . . 0.0 112.542 -174.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -74.39 -11.37 60.23 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.3 1.44 . . . . 0.0 112.292 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 50.48 44.75 26.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.95 1.7 . . . . 0.0 111.363 -177.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.0 t -56.81 168.02 0.69 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 122.151 0.977 . . . . 0.0 111.166 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -56.66 156.87 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.51 0.671 . . . . 0.0 110.668 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -53.61 152.2 5.32 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.921 0.867 . . . . 0.0 110.907 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.38 156.76 46.94 Favored Pre-proline 0 C--N 1.328 -0.329 0 C-N-CA 125.268 1.427 . . . . 0.0 110.521 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 82' ' ' ILE . 55.5 Cg_endo -69.5 153.69 69.79 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.333 2.022 . . . . 0.0 111.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.0 pt -50.92 -39.13 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.401 1.081 . . . . 0.0 112.439 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -64.94 -36.47 84.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.346 1.058 . . . . 0.0 112.134 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.431 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.0 OUTLIER -65.92 -54.86 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.69 -43.13 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 O-C-N 123.367 0.417 . . . . 0.0 111.21 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.47 -44.52 94.21 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.263 1.025 . . . . 0.0 112.992 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -59.93 -57.63 12.06 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.863 0.756 . . . . 0.0 110.994 176.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.706 ' HB ' HD11 ' A' ' 67' ' ' ILE . 24.0 m -59.49 -45.83 93.42 Favored 'Isoleucine or valine' 0 C--N 1.342 0.274 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.035 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 91' ' ' ILE . 82.9 p -55.96 -58.21 8.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.307 0.958 . . . . 0.0 111.487 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 mt -48.64 -53.94 16.6 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.057 0.943 . . . . 0.0 111.12 174.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.15 -46.0 75.68 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 87' ' ' SER . 13.9 mt -54.27 -44.76 72.14 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.416 1.087 . . . . 0.0 111.519 176.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -63.35 -49.85 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.821 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.8 mm -53.33 -45.66 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 118.575 0.625 . . . . 0.0 110.982 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 tp -55.01 -62.89 1.37 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.945 0.898 . . . . 0.0 111.257 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.482 ' HA ' HD23 ' A' ' 97' ' ' LEU . 14.8 t-160 -54.61 -50.77 67.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.791 0.723 . . . . 0.0 111.874 -175.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -55.8 -50.8 69.51 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.904 0.882 . . . . 0.0 112.293 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.09 71.26 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.565 0.62 . . . . 0.0 111.858 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.22 -43.3 64.18 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.066 0.946 . . . . 0.0 110.692 176.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -61.81 -55.57 28.59 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.886 0.875 . . . . 0.0 111.184 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -55.83 -42.24 75.44 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 mtpp -63.16 -48.83 76.76 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.686 0.794 . . . . 0.0 111.593 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -58.98 -38.41 79.07 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.789 0.836 . . . . 0.0 112.123 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 80.8 mt -69.04 -54.89 12.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.778 0.831 . . . . 0.0 112.509 173.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -34.51 71.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 118.931 0.787 . . . . 0.0 111.673 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.9 t -53.32 -51.39 62.53 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.077 1.351 . . . . 0.0 111.289 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -70.38 -28.61 65.24 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -62.36 -26.9 68.71 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.4 t -118.94 -167.38 1.38 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.443 1.097 . . . . 0.0 112.351 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 16.4 t -101.02 119.75 39.19 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.131 0.972 . . . . 0.0 110.957 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.8 p -163.49 128.64 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 126.34 1.856 . . . . 0.0 108.87 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 115.968 -1.967 . . . . 0.0 110.368 171.841 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.354 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -142.67 113.43 7.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.562 1.545 . . . . 0.0 109.292 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.1 167.21 31.49 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.55 0.595 . . . . 0.0 113.247 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.1 m -110.13 84.4 1.92 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.231 1.413 . . . . 0.0 110.291 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.1 t -138.9 31.52 2.22 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.091 1.757 . . . . 0.0 112.025 -178.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.22 152.95 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 124.32 1.048 . . . . 0.0 109.703 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.98 171.5 3.5 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.168 1.787 . . . . 0.0 112.017 174.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -66.3 -17.46 64.77 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -51.69 -43.29 62.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.824 1.65 . . . . 0.0 112.722 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -43.35 85.7 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.984 0.914 . . . . 0.0 112.205 176.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HA ' HD23 ' A' ' 44' ' ' LEU . 87.4 mt -66.14 -47.56 73.65 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.547 1.139 . . . . 0.0 110.042 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -57.48 -42.45 82.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.19 -0.434 . . . . 0.0 110.675 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -61.13 -49.59 76.57 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.094 0.854 . . . . 0.0 113.55 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -58.29 -39.64 79.82 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.508 1.154 . . . . 0.0 111.772 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.29 -30.56 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.03 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -53.92 -50.88 65.42 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.075 1.35 . . . . 0.0 112.029 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.4 p -169.23 51.44 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.9 m -133.92 -61.83 0.78 Allowed 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.825 -0.547 . . . . 0.0 110.877 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.77 -45.78 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 118.313 0.506 . . . . 0.0 111.248 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.5 t -62.86 -38.42 90.76 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.548 0.739 . . . . 0.0 111.487 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 57.6 mt-30 -65.39 -29.66 70.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.486 177.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.76 -45.8 91.15 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.084 0.856 . . . . 0.0 112.09 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.81 -51.19 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.605 0.762 . . . . 0.0 109.956 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.8 mt -58.02 -53.17 61.28 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.418 1.087 . . . . 0.0 110.422 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -57.71 -52.2 66.41 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.041 0.936 . . . . 0.0 110.652 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.3 -42.02 95.31 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.337 0.97 . . . . 0.0 114.014 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 24.1 t -57.09 -59.5 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.153 0.976 . . . . 0.0 110.595 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -66.19 -45.4 80.93 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.44 -175.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 p -58.29 -43.04 87.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.706 0.803 . . . . 0.0 111.43 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.53 -55.44 30.57 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.6 1.095 . . . . 0.0 112.712 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.57 -48.29 81.41 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.17 87.97 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 112.419 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.622 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.04 -50.22 72.87 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.209 173.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.41 -53.87 26.14 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.199 0.909 . . . . 0.0 112.016 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.9 t -60.73 -41.84 96.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.026 0.375 . . . . 0.0 111.688 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -60.44 -40.54 91.48 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.235 -0.916 . . . . 0.0 111.77 176.068 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mt -63.16 -54.59 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 123.775 0.83 . . . . 0.0 109.827 -178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.487 ' HA ' HD12 ' A' ' 71' ' ' ILE . 7.7 p -57.01 -41.58 77.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.667 176.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 65' ' ' THR . 73.8 t -55.94 -53.14 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.421 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.54 ' HB2' HG21 ' A' ' 78' ' ' THR . 10.0 t-105 -56.38 -37.47 70.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.765 1.166 . . . . 0.0 113.16 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 68' ' ' VAL . 30.1 mt -61.72 -53.33 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 118.807 0.731 . . . . 0.0 112.361 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -94.01 -53.42 3.99 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.598 1.159 . . . . 0.0 113.731 -174.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.7 t -64.24 -25.75 68.2 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.916 1.286 . . . . 0.0 111.615 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 50.81 29.47 4.34 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 125.982 1.713 . . . . 0.0 112.791 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.9 t -70.95 132.23 44.9 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.026 0.93 . . . . 0.0 111.812 -173.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -65.91 -6.76 13.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.282 1.433 . . . . 0.0 114.146 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 10.16 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.469 1.908 . . . . 0.0 114.499 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.54 HG21 ' HB2' ' A' ' 70' ' ' TRP . 22.4 p -114.67 78.06 4.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.836 1.655 . . . . 0.0 110.932 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.32 151.98 71.59 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.234 1.956 . . . . 0.0 111.266 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.4 pt -51.03 -38.27 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.488 1.115 . . . . 0.0 112.774 176.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.63 -41.69 97.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.085 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 86' ' ' VAL . 1.5 mt -60.43 -54.56 33.39 Favored 'Isoleucine or valine' 0 C--N 1.345 0.394 0 C-N-CA 123.864 0.866 . . . . 0.0 108.931 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD13 HD11 ' A' ' 66' ' ' LEU . 45.9 mm -63.18 -41.62 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.098 0.559 . . . . 0.0 111.479 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -67.05 -46.08 75.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.244 0.618 . . . . 0.0 111.806 177.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.23 -58.46 8.12 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.501 1.121 . . . . 0.0 111.456 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 66' ' ' LEU . 34.2 m -60.55 -42.05 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.066 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.6 t -55.04 -57.82 10.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.221 1.008 . . . . 0.0 111.516 176.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -53.83 -52.8 59.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.177 175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -53.45 -47.92 69.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 118.008 -0.996 . . . . 0.0 112.778 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.417 HD11 ' HB1' ' A' ' 63' ' ' ALA . 46.6 mt -52.64 -55.14 24.57 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.687 1.195 . . . . 0.0 112.103 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.588 HD12 ' O ' ' A' ' 87' ' ' SER . 3.5 mt -64.7 -48.6 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.521 -0.276 . . . . 0.0 110.895 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.32 -44.7 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 123.613 0.765 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.6 mt -57.9 -55.76 30.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.711 1.205 . . . . 0.0 110.955 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -57.42 -49.29 76.71 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.351 0.978 . . . . 0.0 111.803 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.9 t -61.44 -52.28 65.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.367 0.667 . . . . 0.0 111.282 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.79 93.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.855 0.862 . . . . 0.0 112.026 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.6 mt -55.05 -61.06 2.56 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.461 1.104 . . . . 0.0 110.527 175.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.0 -46.35 91.13 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 117.812 0.278 . . . . 0.0 111.207 -176.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -54.71 -50.52 68.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 112.403 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -63.82 -42.69 97.6 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.324 0.65 . . . . 0.0 112.02 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -59.82 -37.09 78.21 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.791 0.836 . . . . 0.0 112.077 177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.76 -52.38 25.83 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.281 0.633 . . . . 0.0 112.225 172.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.93 -31.46 71.79 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 118.894 0.77 . . . . 0.0 112.382 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.8 t -52.27 -43.59 64.48 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.898 1.679 . . . . 0.0 112.419 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -74.26 -41.66 60.9 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.308 0.504 . . . . 0.0 111.621 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -57.65 -39.99 78.3 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.9 t -72.38 79.3 1.02 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 111.191 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -107.77 159.49 16.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.331 1.452 . . . . 0.0 112.346 174.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -162.12 132.32 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 126.804 2.042 . . . . 0.0 108.166 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . 0.266 14.7 t . . . . . 0 C--O 1.256 1.411 0 CA-C-O 114.752 -2.546 . . . . 0.0 111.421 173.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 108.856 -1.698 . . . . 0.0 108.856 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -153.73 149.34 27.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.465 1.132 . . . . 0.0 109.625 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.89 171.02 47.34 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.141 0.876 . . . . 0.0 113.457 -176.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 m -123.46 148.78 45.85 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.488 1.515 . . . . 0.0 109.699 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t 46.91 32.81 1.96 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.607 1.563 . . . . 0.0 114.041 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.8 mm -76.71 146.77 8.24 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.406 -0.809 . . . . 0.0 109.871 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.55 161.03 2.89 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.386 1.474 . . . . 0.0 112.794 174.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -66.87 -18.49 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.769 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -56.05 -57.4 12.3 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.6 1.16 . . . . 0.0 112.077 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -60.74 -34.99 75.27 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.647 0.779 . . . . 0.0 111.444 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.9 mp -62.2 -59.03 5.64 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.799 1.24 . . . . 0.0 111.395 172.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -53.88 -40.57 66.7 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.828 0.851 . . . . 0.0 110.594 178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -62.98 -48.44 80.53 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 119.229 -0.762 . . . . 0.0 113.703 174.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.35 -39.99 77.1 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.547 1.173 . . . . 0.0 111.938 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 p -81.85 -26.28 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 118.81 -0.614 . . . . 0.0 112.629 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -56.98 -51.76 67.94 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.521 1.128 . . . . 0.0 111.303 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.1 t -166.37 48.24 0.07 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.8 m -131.02 -58.77 1.01 Allowed 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.508 -0.745 . . . . 0.0 111.31 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.3 p -73.01 -45.22 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 118.307 0.503 . . . . 0.0 111.22 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.3 -34.52 77.86 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.622 0.769 . . . . 0.0 111.034 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.516 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.2 tt0 -72.38 -27.95 62.7 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.809 0.844 . . . . 0.0 111.985 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.2 89.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.839 0.856 . . . . 0.0 111.86 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.54 -50.17 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.473 0.709 . . . . 0.0 110.154 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.5 mt -60.05 -53.99 51.32 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.454 1.102 . . . . 0.0 110.309 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -55.78 -50.98 68.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.278 1.031 . . . . 0.0 110.715 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.22 -45.2 96.5 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.968 -0.906 . . . . 0.0 113.604 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.2 t -54.08 -61.38 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.429 1.092 . . . . 0.0 110.429 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -63.81 -38.64 91.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-O 118.356 -0.831 . . . . 0.0 110.747 -176.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 t -54.86 -55.88 25.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.074 1.35 . . . . 0.0 111.655 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.25 -47.98 85.9 Favored Glycine 0 CA--C 1.528 0.891 0 CA-C-N 118.079 0.4 . . . . 0.0 113.072 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.21 81.13 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 117.525 0.662 . . . . 0.0 112.147 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.28 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.1 0.96 . . . . 0.0 111.899 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.68 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.71 -50.68 71.48 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.306 0.503 . . . . 0.0 111.176 174.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -49.53 -58.7 4.71 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.039 0.936 . . . . 0.0 111.856 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 69' ' ' VAL . 7.3 t -55.94 -46.99 78.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.2 -44.36 64.69 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.263 1.025 . . . . 0.0 111.227 177.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.9 mt -62.45 -49.41 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 C-N-CA 124.048 0.939 . . . . 0.0 109.365 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 72' ' ' THR . 8.2 t -53.93 -45.21 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.419 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 65' ' ' THR . 4.1 t -61.52 -48.47 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.541 0.736 . . . . 0.0 111.017 177.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 t90 -54.39 -40.63 68.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.495 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.36 -61.69 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 118.96 0.8 . . . . 0.0 110.73 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 68' ' ' VAL . 9.7 t -65.62 -46.92 77.46 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.217 0.607 . . . . 0.0 112.384 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.2 t -79.95 -0.94 37.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.97 1.308 . . . . 0.0 112.781 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 43.64 47.35 6.39 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.283 1.833 . . . . 0.0 111.938 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.6 t -59.02 165.63 2.38 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 122.049 0.928 . . . . 0.0 110.892 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -168.92 -177.57 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.318 -0.864 . . . . 0.0 109.886 -178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt 58.42 21.42 8.4 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.624 1.169 . . . . 0.0 113.272 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.08 153.41 95.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 C-N-CA 125.498 1.519 . . . . 0.0 111.011 -178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.77 145.31 62.53 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.792 2.328 . . . . 0.0 110.807 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.4 pt -48.09 -40.68 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -46.18 89.13 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.745 1.218 . . . . 0.0 111.762 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.465 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.8 mt -55.75 -55.93 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.554 0.742 . . . . 0.0 109.432 173.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.5 mm -61.8 -38.81 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -57.81 -57.48 12.58 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.758 0.823 . . . . 0.0 110.051 176.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -55.75 -42.17 75.01 Favored 'General case' 0 C--N 1.344 0.345 0 C-N-CA 123.937 0.895 . . . . 0.0 111.851 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 82' ' ' ILE . 74.1 t -57.03 -69.6 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.413 1.085 . . . . 0.0 110.435 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.501 ' O ' HD12 ' A' ' 91' ' ' ILE . 5.1 t -54.16 -48.56 70.76 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.615 0.643 . . . . 0.0 110.958 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 38.4 mt -50.1 -52.25 36.41 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.567 0.747 . . . . 0.0 111.783 173.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -54.2 -47.04 72.54 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 117.96 -1.019 . . . . 0.0 112.331 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.22 -53.44 57.15 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.447 1.021 . . . . 0.0 112.275 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 87' ' ' SER . 3.9 mp -63.99 -50.9 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.751 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.0 mt -55.97 -42.84 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.281 1.033 . . . . 0.0 110.611 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.29 -58.92 5.54 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.23 1.412 . . . . 0.0 110.57 171.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -61.33 -43.86 98.16 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.323 0.511 . . . . 0.0 111.719 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 74.9 m -60.45 -51.3 70.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.884 0.874 . . . . 0.0 112.127 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.73 -45.27 94.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.069 0.548 . . . . 0.0 111.497 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.436 HD23 ' HE3' ' A' ' 100' ' ' LYS . 12.1 mt -55.55 -49.91 71.42 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.525 173.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -59.15 -43.26 92.04 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.306 0.503 . . . . 0.0 111.349 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -60.97 -47.87 84.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 0.0 112.842 176.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HE3' HD23 ' A' ' 97' ' ' LEU . 4.5 ptpt -67.02 -32.46 73.69 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.12 -0.987 . . . . 0.0 112.745 174.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.78 -39.06 80.36 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.066 1.346 . . . . 0.0 112.628 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.43 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.6 pp -75.62 -40.4 56.39 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.985 -0.447 . . . . 0.0 111.056 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.43 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -72.72 -31.91 65.33 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.681 0.673 . . . . 0.0 112.47 -178.691 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.7 p -58.03 -40.18 80.22 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.833 0.853 . . . . 0.0 112.328 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.09 -32.61 50.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.454 1.102 . . . . 0.0 112.703 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.06 -22.98 67.23 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 175.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t -117.08 178.23 4.43 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 112.119 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.0 m -81.72 94.6 7.03 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.317 -0.864 . . . . 0.0 110.096 174.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.4 t -132.15 90.68 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.162 0.985 . . . . 0.0 110.383 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.708 1.603 . . . . 0.0 111.591 175.028 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 CA-C-O 118.431 -1.205 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -146.25 120.55 9.59 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.07 1.348 . . . . 0.0 109.646 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.83 102.18 0.08 OUTLIER Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.366 0.984 . . . . 0.0 113.725 175.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 p -141.99 118.43 10.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.241 1.016 . . . . 0.0 110.441 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -101.04 18.84 18.68 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.485 1.514 . . . . 0.0 112.124 177.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 20.8 mm -73.8 150.32 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 O-C-N 121.294 -0.879 . . . . 0.0 109.206 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.89 173.45 0.6 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.772 1.629 . . . . 0.0 113.063 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -69.59 -8.27 45.89 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 120.64 -1.288 . . . . 0.0 113.957 177.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.7 -40.1 93.83 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.372 1.069 . . . . 0.0 113.038 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.53 -37.19 70.14 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.686 0.676 . . . . 0.0 112.23 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.5 mm? -65.92 -56.05 13.76 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 177.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.76 -40.62 66.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.78 0.432 . . . . 0.0 110.718 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.2 -49.14 68.28 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.016 0.817 . . . . 0.0 113.762 175.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -57.43 -39.67 76.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.582 1.191 . . . . 0.0 111.691 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -84.26 -25.19 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.593 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -55.57 -52.52 63.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.837 1.255 . . . . 0.0 111.248 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.7 t -167.55 50.46 0.06 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.815 0.817 . . . . 0.0 112.089 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 4.1 m -132.17 -46.93 0.92 Allowed 'General case' 0 N--CA 1.482 1.134 0 O-C-N 119.803 -1.811 . . . . 0.0 112.002 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.465 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.9 t -77.17 -54.49 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.724 173.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.7 t -49.9 -42.13 47.34 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.965 0.802 . . . . 0.0 111.614 -176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' HD12 ' A' ' 54' ' ' LEU . 19.9 mt-30 -62.55 -37.46 86.21 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.56 1.144 . . . . 0.0 113.704 175.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.62 -47.22 85.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.06 0.944 . . . . 0.0 111.275 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.465 HD12 ' O ' ' A' ' 49' ' ' VAL . 4.6 mp -57.27 -55.7 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.143 0.577 . . . . 0.0 110.164 175.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 51' ' ' GLN . 11.1 mt -55.66 -50.81 69.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.041 0.936 . . . . 0.0 110.839 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -56.24 -52.38 64.67 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.619 1.168 . . . . 0.0 110.758 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.96 -39.72 89.61 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 119.307 -0.718 . . . . 0.0 113.277 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.5 t -63.59 -63.35 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.251 1.025 . . . . 0.0 110.995 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -56.47 -41.85 77.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.826 0.451 . . . . 0.0 111.099 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 t -64.42 -45.29 88.2 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.163 0.985 . . . . 0.0 111.065 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -57.69 -50.0 69.18 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 119.268 0.94 . . . . 0.0 112.208 177.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.5 -52.66 56.73 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 117.529 0.664 . . . . 0.0 111.73 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.46 79.33 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.691 0.796 . . . . 0.0 111.881 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.94 -49.59 67.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.125 0.57 . . . . 0.0 111.746 176.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 tt -49.91 -58.31 5.68 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.871 0.869 . . . . 0.0 111.211 177.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.2 t -56.76 -40.87 76.58 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.734 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.25 -43.58 78.83 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.507 1.123 . . . . 0.0 111.375 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 71' ' ' ILE . 21.0 mt -66.73 -46.53 85.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.06 -53.62 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.193 0.597 . . . . 0.0 110.778 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.94 -44.38 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.321 0.648 . . . . 0.0 111.055 176.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 78.3 t90 -60.25 -39.63 87.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.303 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mt -65.15 -60.99 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 124.057 0.943 . . . . 0.0 111.503 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -64.48 -42.31 95.95 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.098 0.863 . . . . 0.0 113.033 -174.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.2 m -81.73 -4.86 57.39 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.401 1.08 . . . . 0.0 112.923 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 46.49 46.21 14.08 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.852 1.661 . . . . 0.0 111.895 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.0 138.86 55.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.565 0.698 . . . . 0.0 110.797 -175.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -128.8 10.1 5.96 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.82 76.71 1.52 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 127.117 2.167 . . . . 0.0 110.57 -175.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.23 151.89 53.9 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 124.523 1.129 . . . . 0.0 110.887 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -68.18 126.32 14.22 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.933 2.422 . . . . 0.0 110.983 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.8 pt -48.64 -39.37 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.677 1.191 . . . . 0.0 112.906 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -56.8 -44.3 81.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.497 1.119 . . . . 0.0 111.156 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.573 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.1 mm -61.93 -59.33 4.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.206 0 C-N-CA 123.948 0.899 . . . . 0.0 110.053 175.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.6 mm -57.1 -41.51 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 122.736 0.414 . . . . 0.0 111.403 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -60.83 -51.0 71.17 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.979 0.912 . . . . 0.0 111.878 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -53.61 -45.94 70.24 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.739 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 82' ' ' ILE . 18.0 t -54.72 -59.35 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.219 0.608 . . . . 0.0 110.099 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.57 ' HA ' HD12 ' A' ' 90' ' ' LEU . 5.0 t -55.6 -53.04 61.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 111.574 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mt -49.9 -49.93 47.93 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.641 1.177 . . . . 0.0 112.864 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.79 -45.44 74.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 87' ' ' SER . 15.6 mt -57.15 -39.24 74.84 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.445 0.698 . . . . 0.0 111.252 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 7.7 mm -67.21 -50.68 60.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.401 0.681 . . . . 0.0 110.991 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 33.3 mt -54.67 -46.49 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.429 0.691 . . . . 0.0 109.405 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.86 -53.56 56.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.021 0.928 . . . . 0.0 111.948 172.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.1 t-160 -56.76 -53.44 57.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.4 1.0 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.9 m -61.05 -48.02 83.7 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.626 0.77 . . . . 0.0 111.644 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.66 97.57 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.878 -0.582 . . . . 0.0 112.066 177.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.75 -59.86 4.57 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.952 0.901 . . . . 0.0 111.157 174.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -57.61 -47.9 80.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.0 0.364 . . . . 0.0 110.807 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -55.58 -51.45 67.08 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.477 0.711 . . . . 0.0 112.57 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 81.0 mttt -63.3 -41.56 98.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.286 0.634 . . . . 0.0 112.03 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -60.09 -37.84 81.15 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.774 0.83 . . . . 0.0 111.933 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.9 mt -68.23 -51.75 41.89 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.227 0.611 . . . . 0.0 111.787 173.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -63.58 -31.59 72.8 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.521 0.601 . . . . 0.0 112.141 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -52.57 -49.01 65.82 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.868 1.267 . . . . 0.0 111.038 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -62.56 -40.3 96.42 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -57.77 -27.67 63.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 113.153 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.9 t -131.99 54.8 1.91 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.036 0.935 . . . . 0.0 111.66 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 p -105.02 141.19 37.03 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.983 0.913 . . . . 0.0 111.239 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.53 106.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 126.687 1.995 . . . . 0.0 110.277 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 C--O 1.254 1.342 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.51 176.245 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.335 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -159.71 151.55 20.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.084 1.754 . . . . 0.0 109.026 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.78 -167.49 6.77 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 123.589 0.614 . . . . 0.0 114.28 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -123.5 76.04 1.38 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.287 1.435 . . . . 0.0 110.819 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.0 t -118.03 26.47 9.63 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.997 1.719 . . . . 0.0 112.372 -177.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -105.01 155.22 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 109.593 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.55 175.69 1.01 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.805 1.642 . . . . 0.0 112.287 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -78.52 -11.41 59.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.759 -1.213 . . . . 0.0 113.698 175.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -57.36 -33.52 67.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.225 1.01 . . . . 0.0 112.625 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -55.64 -51.98 65.37 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.619 0.768 . . . . 0.0 111.749 172.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.64 -43.51 97.49 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 125.742 1.617 . . . . 0.0 110.986 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -55.42 -62.55 1.6 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 110.337 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.09 -38.03 83.32 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-N 118.133 0.424 . . . . 0.0 113.057 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.88 -63.54 1.14 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.471 1.509 . . . . 0.0 112.762 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.473 ' HA ' HG12 ' A' ' 49' ' ' VAL . 10.5 p -70.44 -26.44 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -58.08 -56.75 17.99 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.773 1.229 . . . . 0.0 111.629 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.9 p -157.06 42.43 0.34 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.5 m -134.02 -61.8 0.78 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.67 -1.269 . . . . 0.0 110.677 174.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.473 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.0 p -64.0 -41.93 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.462 0.574 . . . . 0.0 111.194 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -63.7 -34.18 77.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 111.605 -178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.515 ' HA ' HD12 ' A' ' 54' ' ' LEU . 24.0 tt0 -68.55 -30.81 69.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.813 0.845 . . . . 0.0 111.592 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.32 -48.62 80.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.414 1.086 . . . . 0.0 112.22 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.2 mp -58.32 -53.8 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.723 0.809 . . . . 0.0 109.674 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 51' ' ' GLN . 26.6 mt -53.84 -49.7 67.85 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.71 1.204 . . . . 0.0 111.277 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -60.55 -48.77 80.29 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 125.138 1.375 . . . . 0.0 111.315 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.45 -41.03 93.1 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 118.411 0.55 . . . . 0.0 113.414 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' ILE . 91.4 t -61.73 -63.14 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.16 0.984 . . . . 0.0 110.501 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -60.47 -31.57 70.58 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.262 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 t -56.74 -64.83 0.74 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.887 1.275 . . . . 0.0 111.757 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.72 -39.93 97.36 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.894 -0.392 . . . . 0.0 112.183 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.7 -51.1 66.54 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.268 0.627 . . . . 0.0 112.179 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.2 86.13 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.526 1.13 . . . . 0.0 111.692 176.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -62.76 -50.61 70.39 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.552 -0.718 . . . . 0.0 112.067 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 tt -54.48 -50.11 68.54 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.885 0.766 . . . . 0.0 112.142 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -61.17 -42.93 99.45 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.401 177.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.8 -37.77 88.02 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-N 119.26 0.936 . . . . 0.0 111.693 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.24 -55.38 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 118.599 0.636 . . . . 0.0 109.447 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.5 m -59.39 -43.42 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 118.858 -0.591 . . . . 0.0 111.026 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.6 p -66.49 -42.08 89.61 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 123.419 0.687 . . . . 0.0 111.252 177.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.262 0.937 . . . . 0.0 111.523 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -67.81 -55.5 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 118.713 0.688 . . . . 0.0 111.005 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.6 t -67.49 -46.25 73.48 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.126 0.875 . . . . 0.0 112.858 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.5 t -78.1 -12.86 60.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.195 1.398 . . . . 0.0 113.212 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmm-85 50.19 54.57 10.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.937 2.095 . . . . 0.0 111.122 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.93 123.01 9.35 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.388 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -40.84 -45.8 2.57 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.395 1.478 . . . . 0.0 114.163 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -169.65 162.36 9.77 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 127.843 2.457 . . . . 0.0 108.8 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.56 157.77 64.21 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.457 1.503 . . . . 0.0 110.119 176.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.95 145.72 62.83 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.611 2.207 . . . . 0.0 110.851 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 20.8 pt -49.01 -40.15 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.692 1.197 . . . . 0.0 112.554 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.03 -41.81 97.29 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.523 1.129 . . . . 0.0 111.876 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.578 ' O ' HG23 ' A' ' 86' ' ' VAL . 8.1 mt -58.72 -56.97 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 123.559 0.744 . . . . 0.0 109.552 171.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.6 mm -60.05 -43.59 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.017 0.527 . . . . 0.0 112.263 -173.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -59.26 -48.82 80.19 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.753 0.821 . . . . 0.0 110.805 177.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -48.94 74.09 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.343 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 82' ' ' ILE . 21.6 t -52.56 -55.5 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 118.529 0.604 . . . . 0.0 109.765 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 91' ' ' ILE . 70.3 m -55.82 -55.46 32.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 118.296 0.498 . . . . 0.0 111.696 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.89 -59.92 3.92 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.457 0.703 . . . . 0.0 110.993 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -52.98 -45.1 67.65 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 117.907 -1.044 . . . . 0.0 112.732 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.8 mp -55.54 -57.47 11.79 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.891 1.277 . . . . 0.0 112.032 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -62.81 -47.43 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 117.735 0.243 . . . . 0.0 110.84 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 66.3 mt -57.1 -44.9 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 123.771 0.828 . . . . 0.0 110.476 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.5 mt -56.09 -55.83 28.27 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.892 172.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -56.66 -47.25 80.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.009 0.822 . . . . 0.0 111.602 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t -59.8 -55.45 34.05 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.38 1.072 . . . . 0.0 111.701 178.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.79 94.06 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 112.631 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.5 -57.73 11.71 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.562 1.145 . . . . 0.0 111.106 174.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.46 -40.32 86.47 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.715 0.234 . . . . 0.0 111.194 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -54.55 -56.96 13.57 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.774 -0.579 . . . . 0.0 112.307 174.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -33.79 71.81 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.907 178.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -71.52 -29.04 64.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.94 1.296 . . . . 0.0 113.677 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 74.6 mt -77.51 -45.0 26.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.967 0.507 . . . . 0.0 111.086 171.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -36.58 80.24 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 118.812 -0.613 . . . . 0.0 112.199 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.6 p -55.61 -39.24 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.093 1.357 . . . . 0.0 113.161 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -72.11 -46.69 55.67 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.798 0.839 . . . . 0.0 110.752 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -56.17 -52.18 65.3 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.883 0.873 . . . . 0.0 112.668 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.2 t -152.05 147.02 25.99 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.424 . . . . 0.0 111.013 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.9 t -135.61 103.75 5.55 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.58 0.752 . . . . 0.0 111.124 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -163.01 124.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.19 1.396 . . . . 0.0 109.914 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.0 m . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.65 1.58 . . . . 0.0 111.263 173.097 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.127 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -148.21 162.95 38.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.306 1.443 . . . . 0.0 109.467 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.69 161.38 17.13 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 125.182 1.372 . . . . 0.0 110.53 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.2 t -151.49 158.61 43.86 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.243 1.417 . . . . 0.0 109.189 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.4 t 47.32 26.66 0.76 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.854 1.662 . . . . 0.0 114.093 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.5 mm -70.94 153.36 8.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 120.794 -1.191 . . . . 0.0 109.34 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.91 160.12 1.02 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.432 1.493 . . . . 0.0 112.285 172.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -63.52 -13.44 41.2 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -49.23 -37.4 23.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.495 1.918 . . . . 0.0 112.913 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -56.02 -57.68 11.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.428 0.691 . . . . 0.0 110.168 175.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.85 -39.37 81.09 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.742 1.217 . . . . 0.0 111.793 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -55.91 -64.58 0.81 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.501 0.72 . . . . 0.0 110.093 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.33 -35.05 83.27 Favored Glycine 0 CA--C 1.538 1.488 0 CA-C-O 119.56 -0.578 . . . . 0.0 113.35 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 4.8 mt -54.97 -66.77 0.35 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.787 1.635 . . . . 0.0 112.368 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 49' ' ' VAL . 7.4 p -70.65 -25.56 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 O-C-N 121.722 -0.611 . . . . 0.0 112.585 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -54.47 -63.63 1.09 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.511 1.124 . . . . 0.0 111.232 174.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.8 m -153.46 49.08 0.68 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 44' ' ' LEU . 89.8 m -139.43 -58.47 0.58 Allowed 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.307 -1.496 . . . . 0.0 111.04 174.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -62.36 -38.76 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.449 0.568 . . . . 0.0 111.431 179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 t -64.09 -35.72 81.68 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.309 1.043 . . . . 0.0 111.411 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -64.96 -31.59 72.91 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.093 0.957 . . . . 0.0 111.827 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.62 -49.56 77.04 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.483 1.113 . . . . 0.0 111.866 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -57.68 -51.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.75 0.82 . . . . 0.0 109.653 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 51' ' ' GLN . 22.8 mt -55.36 -49.29 72.66 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.96 0.904 . . . . 0.0 111.267 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.87 -52.65 64.83 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.399 1.08 . . . . 0.0 110.927 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.73 -35.84 69.41 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-O 119.463 -0.632 . . . . 0.0 113.765 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 53' ' ' ILE . 89.7 t -66.48 -64.15 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.181 0.992 . . . . 0.0 111.063 176.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -57.54 -42.45 82.97 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.473 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.0 t -59.53 -54.67 43.84 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.679 174.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -53.1 -49.89 53.87 Favored Glycine 0 CA--C 1.533 1.181 0 CA-C-N 119.925 1.239 . . . . 0.0 113.274 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.42 -54.76 27.59 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.351 0.575 . . . . 0.0 112.042 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.43 68.75 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.058 0.943 . . . . 0.0 112.319 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 90' ' ' LEU . . . -69.73 -50.57 42.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.825 1.25 . . . . 0.0 111.937 175.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.29 -55.56 20.57 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.118 0.872 . . . . 0.0 111.24 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -56.71 -40.12 75.09 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.014 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.729 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -57.81 -41.72 82.78 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.847 0.859 . . . . 0.0 111.119 177.358 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.44 HD11 HD12 ' A' ' 90' ' ' LEU . 96.8 mt -64.39 -48.02 87.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.09 -57.26 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.571 0.623 . . . . 0.0 111.358 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.9 p -53.37 -41.16 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.872 0.76 . . . . 0.0 111.157 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.555 ' CE3' HG21 ' A' ' 83' ' ' ILE . 67.3 t90 -74.73 -24.62 58.76 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.1 mp -68.95 -36.52 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 119.897 1.226 . . . . 0.0 111.588 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.89 -63.79 1.25 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.44 1.096 . . . . 0.0 112.141 -175.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 t -67.65 -28.94 68.14 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.896 0.878 . . . . 0.0 111.501 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 52.27 25.79 3.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.644 1.578 . . . . 0.0 112.523 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.7 t -52.79 151.62 4.37 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.612 1.165 . . . . 0.0 110.469 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 94.25 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.736 1.614 . . . . 0.0 111.391 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -124.87 -163.43 1.18 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.154 1.382 . . . . 0.0 109.553 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.61 154.21 2.4 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 126.802 2.041 . . . . 0.0 112.599 173.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.12 151.98 76.75 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.898 2.399 . . . . 0.0 111.563 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -43.9 -44.74 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 125.404 1.482 . . . . 0.0 114.0 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -56.99 -48.09 79.26 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.853 0.861 . . . . 0.0 112.243 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.4 ' O ' HG22 ' A' ' 86' ' ' VAL . 1.1 mp -64.64 -40.75 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 C-N-CA 124.237 1.015 . . . . 0.0 109.686 176.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.648 HD12 HD11 ' A' ' 66' ' ' LEU . 41.0 mm -64.89 -34.31 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 119.244 0.929 . . . . 0.0 112.404 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -72.75 -51.28 19.77 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.364 -0.835 . . . . 0.0 112.21 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -47.0 85.71 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.394 -0.812 . . . . 0.0 111.868 176.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 82' ' ' ILE . 29.1 m -63.16 -46.1 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 119.321 0.964 . . . . 0.0 111.059 177.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.619 ' O ' HD12 ' A' ' 91' ' ' ILE . 28.5 t -55.35 -59.34 4.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.068 0.849 . . . . 0.0 111.264 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.2 -51.2 62.89 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.319 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -55.17 -45.33 75.73 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.105 0.779 . . . . 0.0 113.105 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 63' ' ' ALA . 59.0 mt -57.65 -53.57 56.69 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.337 1.055 . . . . 0.0 112.328 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.619 HD12 ' O ' ' A' ' 87' ' ' SER . 2.7 mp -60.11 -50.45 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.335 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.3 mt -54.96 -43.22 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.499 0.72 . . . . 0.0 110.577 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.46 -54.88 41.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.961 0.904 . . . . 0.0 112.187 173.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -58.31 -47.26 84.24 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.844 0.458 . . . . 0.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 m -60.08 -54.17 49.16 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.631 0.772 . . . . 0.0 110.917 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.06 89.15 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.348 0.659 . . . . 0.0 112.145 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.1 mt -56.33 -58.71 6.82 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.883 0.873 . . . . 0.0 111.275 174.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.76 -46.76 88.17 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.608 0.363 . . . . 0.0 111.274 -178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -55.19 -49.47 71.81 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.203 1.001 . . . . 0.0 111.622 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HA ' HD23 ' A' ' 103' ' ' LEU . 64.1 mttm -61.15 -47.2 87.31 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.573 175.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -56.14 -37.68 69.8 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.558 0.743 . . . . 0.0 112.626 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.99 -52.14 32.07 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.189 0.596 . . . . 0.0 112.139 173.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -62.3 -31.05 71.6 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.756 -0.59 . . . . 0.0 112.07 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.0 m -54.33 -36.22 63.53 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.225 1.41 . . . . 0.0 112.583 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -77.57 -48.06 17.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.504 0.593 . . . . 0.0 111.891 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -59.37 -61.35 2.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.777 0.831 . . . . 0.0 113.061 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.2 m -68.82 -65.55 0.69 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.385 0.674 . . . . 0.0 110.137 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 t 59.58 13.57 3.43 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.7 m -134.37 106.66 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 126.961 2.104 . . . . 0.0 110.486 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.998 -1.477 . . . . 0.0 111.379 172.947 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 CA-C-O 118.746 -1.03 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -170.22 -178.64 2.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.592 1.557 . . . . 0.0 109.55 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.04 -176.7 8.32 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.259 0.933 . . . . 0.0 113.986 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.0 p -105.4 93.14 4.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.829 2.052 . . . . 0.0 110.679 -172.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.8 t -135.24 25.51 3.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.954 1.301 . . . . 0.0 112.408 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -87.02 155.62 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 121.578 0.704 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.6 171.79 1.87 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.907 1.283 . . . . 0.0 111.606 175.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -60.76 -12.71 11.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.84 -48.87 66.72 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.366 1.867 . . . . 0.0 112.906 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.92 -43.89 73.72 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.899 0.479 . . . . 0.0 111.671 174.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.22 -54.62 38.29 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.949 1.3 . . . . 0.0 109.975 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -51.34 -41.49 60.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.216 0.916 . . . . 0.0 111.363 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -66.42 -63.12 4.11 Favored Glycine 0 C--N 1.341 0.806 0 CA-C-O 118.644 -1.086 . . . . 0.0 112.894 175.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.46 -34.3 68.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.645 1.722 . . . . 0.0 112.001 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.56 -40.6 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.347 1.059 . . . . 0.0 111.557 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -101.05 20.68 15.12 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.208 1.003 . . . . 0.0 113.167 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.3 t -145.63 -46.38 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.134 0.974 . . . . 0.0 113.529 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.4 m -90.72 -51.64 5.28 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.989 1.316 . . . . 0.0 110.824 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.2 t -71.39 -45.8 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 117.54 -1.219 . . . . 0.0 111.514 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.4 t -45.08 -43.31 9.47 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.942 1.246 . . . . 0.0 111.784 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -38.25 90.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.516 1.127 . . . . 0.0 111.831 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.79 85.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.71 1.204 . . . . 0.0 111.981 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.8 mp -59.65 -56.64 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.631 0.772 . . . . 0.0 109.653 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.04 -50.23 71.54 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.688 0.795 . . . . 0.0 110.528 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -55.79 -52.68 63.14 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 125.126 1.37 . . . . 0.0 111.163 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.4 -42.74 84.15 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 119.572 -0.571 . . . . 0.0 113.006 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 53' ' ' ILE . 95.2 t -61.08 -63.28 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.031 0.932 . . . . 0.0 110.957 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -57.07 -38.85 73.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.52 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.1 t -60.87 -54.13 48.81 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.988 1.315 . . . . 0.0 111.216 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.3 -45.85 93.68 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 123.37 0.51 . . . . 0.0 112.947 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.65 68.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 117.849 0.825 . . . . 0.0 112.294 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.4 -37.15 72.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.225 1.01 . . . . 0.0 112.363 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -65.67 -51.67 57.65 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.911 0.884 . . . . 0.0 112.123 172.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 tt -55.31 -49.18 72.82 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.391 178.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.0 t -62.38 -41.82 98.93 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.514 0.509 . . . . 0.0 112.161 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.634 HD13 HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -63.95 -36.84 85.27 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.049 0.84 . . . . 0.0 111.243 178.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.55 HD13 HD21 ' A' ' 90' ' ' LEU . 55.1 mt -71.82 -54.66 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 121.77 -0.581 . . . . 0.0 109.824 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.522 ' O ' HG22 ' A' ' 72' ' ' THR . 10.8 p -55.86 -50.81 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.318 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.16 -41.6 87.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.978 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -63.24 -33.72 76.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.928 1.24 . . . . 0.0 113.163 178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -70.85 -62.67 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 CA-C-N 118.657 0.662 . . . . 0.0 110.998 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.6 t -74.79 -50.78 16.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.858 0.863 . . . . 0.0 112.586 -175.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.0 m -101.91 54.44 0.81 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 127.916 2.486 . . . . 0.0 109.863 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.18 87.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.646 1.979 . . . . 0.0 113.194 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.1 t -65.57 -74.93 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.976 1.31 . . . . 0.0 108.707 -176.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.4 mmm-85 -149.54 -72.59 0.18 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.836 1.255 . . . . 0.0 111.917 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 174.41 150.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 128.117 2.567 . . . . 0.0 109.841 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.634 HG21 HD13 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -107.32 158.22 33.66 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 125.143 1.377 . . . . 0.0 111.494 177.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG2' HD13 ' A' ' 82' ' ' ILE . 53.3 Cg_endo -69.96 152.38 68.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.26 1.973 . . . . 0.0 111.164 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.7 pt -51.31 -39.7 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.414 1.086 . . . . 0.0 112.534 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -41.25 95.37 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.108 0.963 . . . . 0.0 111.576 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.474 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.1 mp -63.59 -52.51 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 124.863 1.265 . . . . 0.0 108.987 174.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.5 mm -62.23 -31.26 50.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 118.831 0.742 . . . . 0.0 111.832 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -67.36 -58.5 4.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.236 1.014 . . . . 0.0 112.505 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.35 -46.31 83.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.839 0.456 . . . . 0.0 111.429 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HB ' HD11 ' A' ' 67' ' ' ILE . 15.2 m -64.0 -47.67 89.42 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-O 117.317 -1.325 . . . . 0.0 109.298 178.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.3 t -52.34 -54.29 33.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 120.252 1.387 . . . . 0.0 111.926 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 14.2 mt -52.83 -57.18 11.07 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.8 0.273 . . . . 0.0 111.117 176.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -57.39 -36.26 71.05 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.85 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.55 HD21 HD13 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -58.87 -58.6 7.9 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.296 1.838 . . . . 0.0 111.899 -179.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.29 -49.52 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.603 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 73.5 mt -56.41 -38.65 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.384 0.673 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.2 mt -62.07 -57.62 10.91 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.607 173.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -56.03 -48.9 75.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.332 0.969 . . . . 0.0 111.85 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.4 p -61.88 -51.4 68.36 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.479 0.581 . . . . 0.0 112.531 178.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.13 -41.7 98.51 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.283 0.633 . . . . 0.0 112.08 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.38 -49.63 76.54 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.496 1.119 . . . . 0.0 110.96 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -61.48 -47.45 85.6 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.749 0.704 . . . . 0.0 111.25 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.23 -56.38 21.67 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.227 0.611 . . . . 0.0 112.255 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.47 ' HA ' HD23 ' A' ' 103' ' ' LEU . 1.9 pttm -61.47 -34.0 74.71 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.58 -39.84 88.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.174 0.99 . . . . 0.0 112.106 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -65.94 -46.61 77.56 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.171 0.441 . . . . 0.0 111.781 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -66.95 -31.64 72.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.447 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -51.83 -39.69 59.23 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.85 1.26 . . . . 0.0 112.432 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.14 -37.74 45.37 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -56.94 -52.45 65.16 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.538 0.735 . . . . 0.0 111.761 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.4 t -162.71 138.09 6.95 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.0 0.52 . . . . 0.0 111.089 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.4 t -119.25 15.05 13.09 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.631 1.172 . . . . 0.0 112.093 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -167.81 121.06 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.92 2.088 . . . . 0.0 110.957 -175.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 125.257 1.423 . . . . 0.0 112.037 175.171 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.417 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -121.81 -63.17 1.33 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.024 0.93 . . . . 0.0 111.283 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.83 156.75 27.91 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.513 1.054 . . . . 0.0 112.43 -174.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.0 m -129.06 82.33 2.08 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.542 1.137 . . . . 0.0 109.541 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 36' ' ' ILE . 6.4 t -132.72 30.0 4.11 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.725 1.61 . . . . 0.0 111.685 -174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.41 HD12 ' H ' ' A' ' 35' ' ' THR . 2.8 mp -109.92 154.14 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.383 1.473 . . . . 0.0 109.859 -177.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.42 160.4 2.36 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.048 1.739 . . . . 0.0 113.124 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -63.4 -13.55 40.93 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.35 -39.67 10.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.936 2.095 . . . . 0.0 112.667 171.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.68 -56.32 22.73 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.806 0.442 . . . . 0.0 110.485 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.33 -39.67 80.06 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.617 1.167 . . . . 0.0 111.809 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -52.25 -65.11 0.61 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 119.009 -0.519 . . . . 0.0 110.787 171.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.77 -36.9 74.33 Favored Glycine 0 CA--C 1.536 1.406 0 CA-C-N 118.36 0.527 . . . . 0.0 113.838 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.65 -59.38 4.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.684 1.194 . . . . 0.0 112.256 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' HG12 ' A' ' 49' ' ' VAL . 14.7 t -69.37 -26.08 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 O-C-N 121.693 -0.629 . . . . 0.0 111.835 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.23 -56.44 20.96 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.457 1.103 . . . . 0.0 112.351 177.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 t -161.51 52.66 0.25 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.445 0.64 . . . . 0.0 112.515 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.8 m -139.71 -62.29 0.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.641 0.776 . . . . 0.0 110.671 174.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.426 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -63.52 -38.2 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.988 -0.445 . . . . 0.0 110.911 -178.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.8 t -63.39 -34.22 77.26 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.326 1.05 . . . . 0.0 111.723 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.488 ' HA ' HD12 ' A' ' 54' ' ' LEU . 38.3 mt-30 -67.64 -30.19 69.68 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.98 178.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.84 -48.02 83.36 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.346 0.658 . . . . 0.0 111.803 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -59.22 -52.84 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 109.951 178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.3 mt -55.01 -53.07 60.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.343 1.057 . . . . 0.0 110.584 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.43 -47.9 80.57 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.962 1.305 . . . . 0.0 111.71 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.56 -52.57 44.32 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 119.377 -0.679 . . . . 0.0 112.313 173.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' ILE . 88.1 t -54.23 -61.05 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.206 1.002 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.667 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.5 t -57.7 -51.35 69.91 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.146 0.979 . . . . 0.0 111.063 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.16 -52.33 53.97 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-N 118.163 0.438 . . . . 0.0 113.414 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -47.01 85.96 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.5 89.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.916 1.286 . . . . 0.0 112.009 176.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.556 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.36 -51.55 68.36 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.017 0.527 . . . . 0.0 111.431 173.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.9 tt -54.73 -51.71 64.77 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.176 0.898 . . . . 0.0 112.912 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -59.01 -41.93 88.89 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.478 0.581 . . . . 0.0 111.765 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.24 -40.22 95.43 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.556 1.071 . . . . 0.0 111.796 177.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.568 HD11 ' CG1' ' A' ' 86' ' ' VAL . 45.2 mt -58.73 -56.45 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 124.183 0.993 . . . . 0.0 109.431 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 72' ' ' THR . 35.4 m -60.04 -42.54 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 118.697 -0.668 . . . . 0.0 111.897 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 44.3 t -54.03 -47.58 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.059 0.845 . . . . 0.0 110.792 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 91.5 t90 -69.8 -30.71 68.31 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 175.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.7 mt -65.94 -34.03 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 120.715 1.598 . . . . 0.0 112.857 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.7 OUTLIER -107.72 -60.29 1.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.913 0.779 . . . . 0.0 112.47 -179.035 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -71.81 -21.62 61.68 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.222 1.009 . . . . 0.0 113.111 -177.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 45.91 57.09 5.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.625 1.97 . . . . 0.0 112.092 178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 m -50.3 -71.34 0.07 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.974 0.91 . . . . 0.0 112.679 -177.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -151.38 154.95 37.65 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 125.583 1.553 . . . . 0.0 110.28 173.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -69.01 89.87 0.43 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.065 1.346 . . . . 0.0 109.076 174.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 150.33 31.63 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 125.503 1.521 . . . . 0.0 111.191 176.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.419 ' HG2' HD13 ' A' ' 82' ' ' ILE . 56.1 Cg_endo -66.58 150.87 83.8 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.144 1.896 . . . . 0.0 110.821 -176.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 11.1 pt -47.4 -44.1 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.208 1.003 . . . . 0.0 111.97 177.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -56.7 -45.16 81.97 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.581 1.152 . . . . 0.0 113.009 178.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.523 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -59.66 -54.7 30.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.7 mm -61.75 -44.89 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.535 0.607 . . . . 0.0 112.069 -175.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -55.54 -50.66 69.43 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.386 1.074 . . . . 0.0 111.723 174.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -56.8 -49.0 76.68 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.264 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.568 ' CG1' HD11 ' A' ' 67' ' ' ILE . 91.4 t -51.31 -57.27 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 123.799 0.84 . . . . 0.0 110.482 179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.591 ' O ' HD12 ' A' ' 91' ' ' ILE . 4.3 t -54.92 -55.21 33.13 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.103 0.41 . . . . 0.0 111.856 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.8 -61.14 2.44 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.351 0.66 . . . . 0.0 111.399 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -51.22 -49.44 61.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.694 0.798 . . . . 0.0 111.829 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 67' ' ' ILE . 3.4 mp -49.78 -58.64 4.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.281 1.032 . . . . 0.0 112.615 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.591 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mt -61.93 -46.86 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 119.505 -0.284 . . . . 0.0 110.832 -179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -55.01 -45.62 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.933 0.893 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.59 -56.86 16.66 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 124.609 1.163 . . . . 0.0 111.852 173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -56.43 -46.48 80.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.811 0.732 . . . . 0.0 111.392 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.7 t -60.12 -51.92 67.53 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.397 1.079 . . . . 0.0 111.659 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.49 88.62 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.181 0.993 . . . . 0.0 112.833 177.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.6 mt -56.77 -57.76 11.06 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.735 1.214 . . . . 0.0 111.094 176.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -46.44 89.33 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.826 0.45 . . . . 0.0 110.965 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -54.66 -53.95 48.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.813 0.845 . . . . 0.0 112.433 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -58.09 -44.39 87.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.064 0.546 . . . . 0.0 111.316 177.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -60.22 -41.27 92.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.961 0.505 . . . . 0.0 112.344 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 70.3 mt -68.26 -45.41 73.24 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.235 1.014 . . . . 0.0 112.475 175.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -28.65 67.72 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.388 0.675 . . . . 0.0 111.918 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -59.93 -57.54 12.44 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.751 1.22 . . . . 0.0 112.478 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -74.8 -6.22 47.77 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.56 -174.19 0.84 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.567 1.547 . . . . 0.0 111.423 170.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 9.7 t -49.85 94.27 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.512 1.525 . . . . 0.0 113.509 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.1 m -99.15 6.88 46.26 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.805 1.242 . . . . 0.0 112.609 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.5 p -163.09 125.8 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 126.923 2.089 . . . . 0.0 109.386 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 115.778 -2.058 . . . . 0.0 113.102 175.431 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.743 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -65.89 104.67 1.14 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.004 1.402 . . . . 0.0 110.657 -178.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -161.85 -48.81 0.02 OUTLIER Glycine 0 CA--C 1.531 1.088 0 N-CA-C 114.939 0.736 . . . . 0.0 114.939 -178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 t -145.01 161.55 39.12 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.382 1.073 . . . . 0.0 110.518 173.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.2 t 43.0 31.75 0.36 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.942 1.697 . . . . 0.0 113.881 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.511 HD12 ' H ' ' A' ' 36' ' ' ILE . 1.7 mp -70.48 157.93 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 121.049 -1.032 . . . . 0.0 109.364 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.18 161.85 1.19 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.849 1.659 . . . . 0.0 112.227 172.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -59.53 -14.86 14.63 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -54.15 -36.21 63.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.632 1.973 . . . . 0.0 112.059 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -62.01 -54.94 34.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.414 0.686 . . . . 0.0 111.58 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.97 -41.33 87.28 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.007 0.923 . . . . 0.0 111.417 176.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.59 -65.8 0.5 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.522 0.729 . . . . 0.0 110.365 172.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.37 -32.56 60.79 Favored Glycine 0 CA--C 1.537 1.432 0 CA-C-N 119.098 0.863 . . . . 0.0 113.446 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -60.64 3.07 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.345 -1.68 . . . . 0.0 112.241 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -79.27 -7.61 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.826 0.739 . . . . 0.0 112.655 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -110.8 0.0 17.13 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.562 1.545 . . . . 0.0 113.721 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 m -145.78 -40.93 0.22 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.229 1.412 . . . . 0.0 113.433 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.5 m -89.4 -76.71 0.41 Allowed 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.088 0.858 . . . . 0.0 110.523 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 1.4 t -59.03 -32.42 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.713 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 t -48.07 -38.81 18.32 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.926 0.785 . . . . 0.0 111.793 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 54' ' ' LEU . 25.5 mt-30 -68.11 -33.65 74.92 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 123.149 0.579 . . . . 0.0 112.206 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.8 94.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.057 0.943 . . . . 0.0 111.6 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.467 HD12 ' H ' ' A' ' 53' ' ' ILE . 5.2 mp -61.16 -56.22 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.28 0.632 . . . . 0.0 109.993 174.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.5 mt -55.04 -51.55 65.96 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.115 0.966 . . . . 0.0 110.64 -177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -56.97 -48.47 78.31 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 111.283 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.82 95.43 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.279 -0.734 . . . . 0.0 113.322 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.76 -61.79 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.265 1.026 . . . . 0.0 110.823 178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -56.94 -39.21 74.08 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.2 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -57.36 -57.81 10.99 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.859 1.263 . . . . 0.0 111.417 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.91 -48.54 85.08 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-N 118.28 0.491 . . . . 0.0 112.895 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.69 -47.61 84.53 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.293 0.546 . . . . 0.0 112.23 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.04 75.39 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 123.933 0.893 . . . . 0.0 111.959 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.636 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.73 -51.61 61.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 175.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' ILE . 1.1 tt -54.46 -51.41 65.1 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.603 0.638 . . . . 0.0 112.359 177.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -59.11 -39.58 82.69 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.545 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.57 -41.98 99.26 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.433 1.015 . . . . 0.0 111.775 175.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 64' ' ' LEU . 31.3 mt -58.02 -55.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.912 0.885 . . . . 0.0 109.298 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.424 ' O ' HG22 ' A' ' 72' ' ' THR . 35.9 m -59.52 -43.73 91.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 118.645 -0.693 . . . . 0.0 112.047 177.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.6 t -53.43 -46.19 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 119.081 0.855 . . . . 0.0 110.777 176.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 51.4 t90 -72.57 -26.9 61.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 175.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 28.9 mt -67.43 -38.37 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 120.234 1.379 . . . . 0.0 112.246 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -102.67 -64.54 1.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.297 1.039 . . . . 0.0 112.259 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -71.61 -23.44 61.71 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.439 1.095 . . . . 0.0 113.089 -176.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 51.78 43.01 30.34 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.565 1.946 . . . . 0.0 113.363 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.4 t -44.41 -65.4 0.52 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.125 1.77 . . . . 0.0 113.326 -173.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -122.44 130.51 53.15 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.885 1.274 . . . . 0.0 109.782 175.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.89 62.46 2.09 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.924 1.289 . . . . 0.0 110.342 175.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -52.18 148.7 10.96 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 125.244 1.418 . . . . 0.0 111.753 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.428 ' HG2' HD13 ' A' ' 82' ' ' ILE . 56.6 Cg_endo -66.18 151.19 84.2 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.5 2.133 . . . . 0.0 110.749 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.3 pt -47.65 -45.09 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.517 1.127 . . . . 0.0 111.93 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -55.53 -45.53 77.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.027 1.331 . . . . 0.0 112.927 177.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.596 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.0 OUTLIER -60.83 -53.76 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 176.278 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.9 mm -60.04 -47.84 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.139 0.427 . . . . 0.0 111.55 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -57.74 -45.04 86.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.722 0.809 . . . . 0.0 111.623 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -55.75 -51.97 65.53 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-O 117.881 -1.056 . . . . 0.0 111.641 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 82' ' ' ILE . 21.4 t -50.76 -54.8 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 118.826 0.739 . . . . 0.0 109.977 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.1 t -54.98 -61.46 2.3 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.276 0.63 . . . . 0.0 112.558 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mt -53.56 -50.91 64.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.201 1.001 . . . . 0.0 112.806 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.9 -41.67 87.76 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.105 0.962 . . . . 0.0 112.182 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.506 HD11 ' CB ' ' A' ' 63' ' ' ALA . 3.5 mp -55.87 -42.61 76.16 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.272 1.029 . . . . 0.0 111.358 174.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 6.2 mm -64.84 -45.95 93.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 118.58 0.627 . . . . 0.0 111.143 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.5 mt -58.68 -46.77 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 123.528 0.731 . . . . 0.0 109.565 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 25.0 tp -56.98 -52.66 64.36 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.174 0.99 . . . . 0.0 111.801 171.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -59.76 -48.75 80.42 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.155 0.889 . . . . 0.0 111.86 -177.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.4 m -61.48 -49.55 76.33 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.412 1.085 . . . . 0.0 111.236 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.15 98.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.769 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 97' ' ' LEU . 12.6 mt -58.2 -52.55 65.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 123.898 0.879 . . . . 0.0 111.481 173.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.12 -48.68 79.07 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.801 0.728 . . . . 0.0 111.378 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.47 -54.13 50.48 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.565 0.746 . . . . 0.0 112.213 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.419 ' HA ' HD23 ' A' ' 103' ' ' LEU . 12.1 pttt -61.19 -36.83 80.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.796 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.51 -42.97 98.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.778 0.831 . . . . 0.0 111.535 177.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -64.72 -50.13 68.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.809 0.444 . . . . 0.0 111.571 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -62.73 -35.69 80.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.863 -0.589 . . . . 0.0 111.961 -179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -52.06 -34.8 45.1 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.678 1.591 . . . . 0.0 112.594 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.59 -41.15 18.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.32 -52.3 66.23 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.632 0.773 . . . . 0.0 113.033 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 t -168.64 152.42 5.62 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.34 0.656 . . . . 0.0 111.2 175.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 76.6 p -97.11 145.38 26.05 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.73 -0.606 . . . . 0.0 111.496 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.37 104.93 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.168 1.387 . . . . 0.0 109.739 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.63 -1.652 . . . . 0.0 110.872 169.902 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -152.5 139.84 19.49 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.628 1.171 . . . . 0.0 109.581 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.72 173.59 13.0 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.63 1.586 . . . . 0.0 112.309 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -142.74 166.99 23.13 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.483 1.913 . . . . 0.0 109.624 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.4 t 44.76 29.89 0.48 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.522 1.529 . . . . 0.0 114.553 -177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.541 HD12 ' H ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -68.66 157.67 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 123.385 0.674 . . . . 0.0 109.43 -176.423 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.27 164.91 1.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.493 1.517 . . . . 0.0 112.074 175.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -83.22 -9.23 59.26 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.258 -0.901 . . . . 0.0 113.303 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.51 -59.68 4.8 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.786 1.235 . . . . 0.0 111.572 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -54.15 -44.0 71.07 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.558 0.743 . . . . 0.0 111.375 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.69 -49.28 78.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.35 1.06 . . . . 0.0 112.858 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -56.74 -57.18 13.54 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.765 0.826 . . . . 0.0 110.021 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.67 -38.53 82.65 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-O 119.659 -0.523 . . . . 0.0 113.374 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.29 -63.78 1.11 Allowed 'General case' 0 C--N 1.343 0.296 0 C-N-CA 125.681 1.592 . . . . 0.0 112.579 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.12 -28.23 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -58.0 -59.29 5.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.478 1.111 . . . . 0.0 112.298 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.4 t -155.52 61.34 0.61 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.703 1.24 . . . . 0.0 111.676 -177.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.3 m -151.24 -57.91 0.16 Allowed 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.118 -1.614 . . . . 0.0 110.525 173.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 45' ' ' VAL . 0.8 OUTLIER -65.33 -40.89 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.252 0.478 . . . . 0.0 111.228 178.146 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.9 t -63.02 -37.1 85.83 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.34 1.056 . . . . 0.0 111.201 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.463 ' HA ' HD12 ' A' ' 54' ' ' LEU . 26.4 tt0 -66.3 -30.01 70.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.92 0.888 . . . . 0.0 112.324 178.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.8 84.47 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.507 0.723 . . . . 0.0 111.944 178.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mp -58.62 -49.5 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.399 0.68 . . . . 0.0 110.035 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 51' ' ' GLN . 14.4 mt -59.59 -54.81 42.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.117 0.967 . . . . 0.0 110.496 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -55.65 -52.77 62.69 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.769 0.828 . . . . 0.0 110.601 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -56.97 -43.75 92.94 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.286 0.946 . . . . 0.0 113.824 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.1 t -56.29 -60.49 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 118.433 1.117 . . . . 0.0 110.536 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -63.03 -42.59 99.8 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.649 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.0 m -57.51 -48.5 79.09 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 124.258 1.023 . . . . 0.0 112.411 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.68 -48.27 78.91 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 119.511 1.051 . . . . 0.0 112.79 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.13 75.35 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 117.33 0.565 . . . . 0.0 111.471 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.35 -38.39 83.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.351 1.06 . . . . 0.0 112.196 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.504 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -63.73 -52.47 60.31 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.584 0.754 . . . . 0.0 111.558 173.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.77 -49.7 65.01 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.858 0.753 . . . . 0.0 111.891 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG12 ' A' ' 69' ' ' VAL . 9.4 t -62.25 -41.37 98.37 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 117.517 -1.23 . . . . 0.0 111.988 177.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.504 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.49 -34.16 77.61 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.848 1.204 . . . . 0.0 112.239 177.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.8 mt -71.57 -54.9 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.461 0.704 . . . . 0.0 109.546 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.0 m -57.11 -44.4 83.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 118.964 -0.541 . . . . 0.0 111.184 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 65' ' ' THR . 11.1 p -63.52 -43.11 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 123.636 0.774 . . . . 0.0 111.539 175.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -35.99 76.27 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.164 1.347 . . . . 0.0 113.055 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -72.12 -56.01 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 123.051 0.54 . . . . 0.0 110.699 176.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -68.25 -38.67 82.05 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.097 0.862 . . . . 0.0 113.287 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.0 t -82.33 -14.58 55.09 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.837 1.255 . . . . 0.0 112.401 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 51.26 63.4 2.26 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.992 1.717 . . . . 0.0 111.678 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -49.2 119.17 3.1 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.827 0.851 . . . . 0.0 112.314 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -57.88 -66.77 0.42 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.788 1.635 . . . . 0.0 113.007 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.4 mtmm -98.6 107.88 20.44 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.077 1.351 . . . . 0.0 109.613 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.02 108.78 37.8 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 125.237 1.415 . . . . 0.0 111.252 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.04 112.42 2.5 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.025 2.484 . . . . 0.0 111.716 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.5 pt -45.08 -37.69 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.752 1.621 . . . . 0.0 113.602 176.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -55.54 -52.17 64.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.04 1.336 . . . . 0.0 111.473 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.589 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.6 mp -58.09 -52.01 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 124.66 1.184 . . . . 0.0 109.408 175.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.1 mm -57.16 -45.74 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.084 0.402 . . . . 0.0 111.286 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -59.88 -47.73 84.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.836 0.854 . . . . 0.0 111.999 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -54.99 -46.03 75.11 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.827 173.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 82' ' ' ILE . 14.7 t -55.77 -56.09 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 123.082 0.553 . . . . 0.0 109.758 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.641 ' O ' HD12 ' A' ' 91' ' ' ILE . 11.2 t -52.95 -56.66 14.32 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.416 0.553 . . . . 0.0 112.151 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.09 -59.79 3.79 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.387 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -53.21 -44.22 67.83 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.921 0.888 . . . . 0.0 113.112 -178.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.89 -48.42 70.13 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.981 1.313 . . . . 0.0 111.851 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 87' ' ' SER . 2.5 mp -62.32 -47.37 93.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.056 175.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 36.7 mm -55.02 -45.65 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 118.435 0.561 . . . . 0.0 110.755 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.68 -62.38 1.7 Allowed 'General case' 0 C--N 1.342 0.266 0 C-N-CA 124.034 0.934 . . . . 0.0 111.112 171.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.544 ' HA ' HD23 ' A' ' 97' ' ' LEU . 3.5 t60 -56.56 -45.2 81.39 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.34 0.518 . . . . 0.0 111.483 -174.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.5 t -59.85 -51.56 69.18 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.022 1.329 . . . . 0.0 112.344 177.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.0 91.7 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.101 0.56 . . . . 0.0 111.939 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.544 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.28 -41.92 80.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.139 0.576 . . . . 0.0 110.565 174.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -63.12 -51.48 66.34 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.617 0.644 . . . . 0.0 110.824 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -56.65 -46.95 80.73 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.71 175.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -45.12 90.18 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.514 0.597 . . . . 0.0 111.565 176.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.05 -44.53 95.59 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.537 0.735 . . . . 0.0 111.06 -177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.2 mt -63.42 -49.22 74.61 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.119 0.567 . . . . 0.0 112.001 175.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -36.09 83.25 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.711 0.687 . . . . 0.0 112.028 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.3 m -65.86 -46.5 78.23 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.352 1.061 . . . . 0.0 112.213 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -59.46 -35.44 74.07 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -59.85 -38.99 83.7 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.4 t -164.75 119.2 1.35 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.713 0.688 . . . . 0.0 111.685 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 77.6 p -120.75 159.91 24.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.236 1.415 . . . . 0.0 112.004 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.0 m -143.03 119.55 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 126.148 1.779 . . . . 0.0 109.927 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.238 0 C-N-CA 126.879 2.072 . . . . 0.0 112.54 170.655 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.182 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -76.8 -179.87 5.67 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.595 0.758 . . . . 0.0 112.344 175.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.5 99.67 0.13 Allowed Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.822 1.201 . . . . 0.0 111.928 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -143.23 153.83 43.21 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.292 1.437 . . . . 0.0 110.319 173.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t 43.5 33.29 0.62 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 126.55 1.94 . . . . 0.0 113.605 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 36' ' ' ILE . 1.7 mp -70.97 155.71 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.093 -1.004 . . . . 0.0 109.711 -176.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.74 156.45 3.61 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 125.79 1.636 . . . . 0.0 112.007 173.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -63.04 -12.5 26.73 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -49.37 -56.39 9.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.263 1.425 . . . . 0.0 111.846 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -60.12 -46.07 90.85 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 119.281 -0.39 . . . . 0.0 110.421 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mp -56.84 -51.93 67.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.382 1.473 . . . . 0.0 111.507 177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -55.12 -57.96 9.6 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.242 1.017 . . . . 0.0 110.516 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.98 -38.35 84.69 Favored Glycine 0 CA--C 1.54 1.618 0 CA-C-N 118.131 0.423 . . . . 0.0 113.504 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mt -57.36 -62.68 1.6 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.762 1.625 . . . . 0.0 112.072 176.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 19.6 m -67.86 -24.25 30.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.79 -54.08 49.54 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.309 1.044 . . . . 0.0 112.761 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -162.14 52.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.009 0.909 . . . . 0.0 111.745 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.2 m -143.59 -57.08 0.4 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.763 -1.211 . . . . 0.0 110.611 172.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -41.87 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.579 0.627 . . . . 0.0 111.206 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -62.09 -36.92 83.14 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.142 0.977 . . . . 0.0 111.567 -177.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.509 ' HA ' HD12 ' A' ' 54' ' ' LEU . 17.7 tm0? -64.74 -31.91 73.36 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.065 0.946 . . . . 0.0 111.813 -179.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.66 -49.2 78.67 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 112.191 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.35 -50.41 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.535 0.734 . . . . 0.0 110.028 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 51' ' ' GLN . 16.2 mt -55.91 -54.13 48.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.996 0.919 . . . . 0.0 110.401 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -55.82 -48.31 75.65 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.292 1.037 . . . . 0.0 111.086 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.09 -43.32 95.25 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-O 119.377 -0.679 . . . . 0.0 113.43 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 53' ' ' ILE . 76.8 t -61.26 -60.82 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.206 1.003 . . . . 0.0 110.992 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -57.25 -41.58 79.86 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.1 t -62.07 -51.52 67.61 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 124.289 1.036 . . . . 0.0 111.373 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.23 -48.48 74.49 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 118.739 0.699 . . . . 0.0 112.907 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.19 -49.61 75.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 117.004 0.402 . . . . 0.0 111.831 175.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.1 76.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.253 1.021 . . . . 0.0 112.655 176.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.526 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.21 -51.32 58.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.134 0.974 . . . . 0.0 111.33 175.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.9 tt -53.36 -49.9 66.19 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.739 0.699 . . . . 0.0 111.602 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -61.93 -42.8 99.52 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.048 -0.977 . . . . 0.0 111.93 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.526 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -61.76 -37.87 85.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.353 0.979 . . . . 0.0 111.488 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.765 HD11 HG13 ' A' ' 86' ' ' VAL . 39.9 mt -69.28 -55.52 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.646 0.657 . . . . 0.0 109.888 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.8 m -59.86 -43.14 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-O 118.657 -0.687 . . . . 0.0 110.818 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.4 p -66.2 -41.36 89.14 Favored 'Isoleucine or valine' 0 C--N 1.348 0.521 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.155 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -60.76 -40.96 94.48 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.323 0.965 . . . . 0.0 111.862 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.64 -58.49 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 118.427 0.558 . . . . 0.0 110.612 176.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.9 t -64.86 -46.51 81.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.4 t -77.86 -6.22 53.53 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.469 1.108 . . . . 0.0 112.881 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 41.51 47.29 3.21 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.245 1.818 . . . . 0.0 111.471 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.0 t -57.63 160.49 4.3 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.734 0.778 . . . . 0.0 110.427 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -54.69 155.68 4.04 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.055 0.942 . . . . 0.0 110.645 -178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.11 152.99 7.13 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 122.049 0.928 . . . . 0.0 110.939 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.444 ' OG1' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -111.05 154.86 43.29 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 125.884 1.673 . . . . 0.0 110.487 -176.526 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.441 ' HG2' HD13 ' A' ' 82' ' ' ILE . 58.2 Cg_endo -68.47 153.15 74.47 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.265 1.977 . . . . 0.0 110.919 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.1 pt -49.1 -40.28 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 124.469 1.108 . . . . 0.0 112.779 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -59.99 -46.7 88.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.607 1.163 . . . . 0.0 112.61 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.441 HD13 ' HG2' ' A' ' 79' ' ' PRO . 1.1 mp -59.41 -50.74 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.369 1.068 . . . . 0.0 109.471 176.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.444 HD11 ' OG1' ' A' ' 78' ' ' THR . 47.6 mm -64.8 -38.42 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.857 -0.527 . . . . 0.0 111.514 -178.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.23 -63.02 1.29 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 110.404 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -54.86 -43.68 73.33 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.394 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.765 HG13 HD11 ' A' ' 67' ' ' ILE . 38.1 t -56.65 -67.81 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.992 1.317 . . . . 0.0 110.618 178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 91' ' ' ILE . 48.3 t -52.75 -49.99 64.37 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.157 0.583 . . . . 0.0 110.863 -175.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.92 -51.15 43.2 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.536 0.734 . . . . 0.0 110.957 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.38 -47.79 62.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.67 0.788 . . . . 0.0 113.023 177.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -59.52 -52.34 66.01 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.651 0.659 . . . . 0.0 111.866 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 87' ' ' SER . 3.3 mp -62.08 -49.77 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.728 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.9 mt -57.48 -43.25 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.904 0.882 . . . . 0.0 110.3 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.45 -57.81 10.36 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.739 0.815 . . . . 0.0 111.107 172.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -57.44 -47.61 81.35 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.448 0.567 . . . . 0.0 111.498 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.9 t -60.11 -54.27 47.93 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.214 1.006 . . . . 0.0 111.795 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.95 96.57 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.126 0.97 . . . . 0.0 112.647 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.73 -55.62 31.93 Favored 'General case' 0 C--N 1.344 0.342 0 C-N-CA 123.788 0.835 . . . . 0.0 110.756 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -57.73 -42.06 83.09 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.332 0.653 . . . . 0.0 111.469 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -56.2 -66.24 0.47 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.157 0.583 . . . . 0.0 110.065 175.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.9 pttt -55.95 -36.63 68.0 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -54.52 -44.38 72.73 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.507 1.923 . . . . 0.0 110.522 177.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.24 -27.88 21.49 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.307 -0.854 . . . . 0.0 111.962 177.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.62 -57.16 9.84 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.117 2.167 . . . . 0.0 112.577 -175.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.0 p -62.52 -23.83 67.17 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.132 0.973 . . . . 0.0 112.983 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -99.38 11.92 37.78 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.83 1.652 . . . . 0.0 112.515 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -86.29 -57.94 2.82 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.122 0.874 . . . . 0.0 111.852 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.8 t -75.62 68.13 2.19 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.911 1.284 . . . . 0.0 110.514 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 t -160.9 136.63 8.08 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.673 0.789 . . . . 0.0 111.126 175.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 47.4 t -136.69 90.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 125.226 1.41 . . . . 0.0 108.739 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.624 -1.655 . . . . 0.0 111.342 175.066 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.448 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -81.81 -39.56 23.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.49 173.46 21.72 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.773 1.177 . . . . 0.0 112.595 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 m -131.46 80.8 1.95 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.145 1.378 . . . . 0.0 110.449 -175.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.409 ' H ' HD12 ' A' ' 36' ' ' ILE . 11.3 t -129.35 36.23 4.16 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.527 1.931 . . . . 0.0 111.222 -177.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 35' ' ' THR . 2.5 mp -131.42 156.37 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.651 1.18 . . . . 0.0 108.737 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.0 163.1 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.44 1.896 . . . . 0.0 111.948 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -62.07 -10.64 10.68 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -54.91 -35.98 64.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.574 1.949 . . . . 0.0 112.564 177.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -58.01 -57.3 13.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.795 0.838 . . . . 0.0 110.791 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.21 -40.06 84.6 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.61 1.164 . . . . 0.0 111.568 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -51.14 -66.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.638 0.775 . . . . 0.0 110.855 171.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -56.99 -37.36 78.7 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 118.354 0.525 . . . . 0.0 113.677 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.7 mt -54.37 -58.31 7.93 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.887 1.275 . . . . 0.0 112.492 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.411 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.1 t -71.15 -25.3 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.525 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -56.0 -56.42 20.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.021 1.328 . . . . 0.0 112.509 178.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.4 t -163.53 61.33 0.17 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.617 1.199 . . . . 0.0 111.428 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.9 m -149.51 -58.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.876 -1.765 . . . . 0.0 110.889 172.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.1 p -60.84 -41.02 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.505 0.593 . . . . 0.0 111.282 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -62.16 -36.69 82.63 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.742 1.217 . . . . 0.0 111.525 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.51 -35.55 77.65 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.902 0.881 . . . . 0.0 110.715 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.87 98.44 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.701 0.8 . . . . 0.0 112.729 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mt -63.31 -66.01 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.563 0.745 . . . . 0.0 109.5 176.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.409 HD12 ' N ' ' A' ' 55' ' ' PHE . 3.7 pp -53.77 -37.53 63.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.458 0.703 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.409 ' N ' HD12 ' A' ' 54' ' ' LEU . 76.5 t80 -55.52 -52.87 62.25 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.326 1.05 . . . . 0.0 110.869 175.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -63.56 -35.17 91.68 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.663 -1.076 . . . . 0.0 112.778 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 77.7 t -59.31 -65.2 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 CA-C-N 119.006 1.403 . . . . 0.0 111.486 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.9 ptp85 -60.85 -41.29 95.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.778 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.9 m -61.33 -46.72 89.07 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.678 0.791 . . . . 0.0 110.6 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.64 -57.36 19.93 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 124.276 0.941 . . . . 0.0 112.078 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.07 -50.58 72.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.746 0.773 . . . . 0.0 112.051 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.94 -37.98 84.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.809 0.843 . . . . 0.0 112.74 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.707 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -66.88 -48.97 67.11 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.948 0.794 . . . . 0.0 112.46 175.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -51.81 -56.51 13.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.969 0.804 . . . . 0.0 110.802 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.3 t -56.74 -41.22 77.14 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.009 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -52.57 -44.9 66.19 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.654 1.181 . . . . 0.0 111.345 174.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.685 HD11 HG12 ' A' ' 86' ' ' VAL . 42.1 mt -65.84 -46.76 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.35 -51.0 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.72 178.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.5 p -60.52 -44.55 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.844 176.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -35.87 80.17 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.98 1.264 . . . . 0.0 112.933 178.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.98 -52.34 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.092 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.2 t -71.9 -43.63 65.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.532 0.733 . . . . 0.0 112.521 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.4 t -77.6 -15.54 59.16 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.039 0.936 . . . . 0.0 112.31 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 mmt-85 47.14 67.47 0.79 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.255 1.822 . . . . 0.0 111.397 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.3 t -48.65 -74.72 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.425 0.69 . . . . 0.0 111.95 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -156.78 175.42 14.09 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 126.955 2.102 . . . . 0.0 110.276 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.24 62.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.655 1.582 . . . . 0.0 110.684 173.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.98 151.19 35.14 Favored Pre-proline 0 N--CA 1.467 0.425 0 C-N-CA 123.995 0.918 . . . . 0.0 111.719 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.25 129.1 21.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.717 2.278 . . . . 0.0 110.876 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.8 pt -47.98 -40.43 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.99 1.316 . . . . 0.0 112.584 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -47.33 76.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.821 1.648 . . . . 0.0 111.586 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 86' ' ' VAL . 11.9 mm -60.29 -58.93 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.083 0.953 . . . . 0.0 109.764 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.44 -41.78 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 CA-C-N 118.281 0.491 . . . . 0.0 111.555 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.12 -56.39 22.67 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.554 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -50.45 -43.84 55.33 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.133 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.685 HG12 HD11 ' A' ' 67' ' ' ILE . 5.4 t -59.22 -61.13 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 118.913 0.779 . . . . 0.0 110.736 177.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.583 ' O ' HD12 ' A' ' 91' ' ' ILE . 49.0 m -56.07 -50.71 70.24 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.291 0.496 . . . . 0.0 111.674 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.4 -53.12 58.32 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.069 0.948 . . . . 0.0 111.303 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -49.05 -45.58 43.05 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.494 0.718 . . . . 0.0 111.875 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' A' ' 63' ' ' ALA . 33.7 mt -56.96 -57.79 11.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.102 0.961 . . . . 0.0 112.555 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.583 HD12 ' O ' ' A' ' 87' ' ' SER . 3.1 mt -63.64 -46.39 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 119.489 -0.291 . . . . 0.0 110.416 -178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 64.5 mt -58.31 -45.1 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 124.146 0.979 . . . . 0.0 110.43 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -55.4 -58.48 7.56 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.926 1.29 . . . . 0.0 111.14 171.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -58.55 -45.19 89.47 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.167 0.44 . . . . 0.0 111.799 -175.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.4 m -58.52 -56.2 25.16 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.993 1.317 . . . . 0.0 111.503 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.57 -45.33 81.38 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.74 0.7 . . . . 0.0 111.632 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.02 -63.26 1.27 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.916 0.886 . . . . 0.0 112.068 175.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.99 -46.98 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 -176.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -57.32 -54.6 44.99 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.924 0.89 . . . . 0.0 111.63 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -57.58 -38.24 74.52 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.333 -0.854 . . . . 0.0 111.899 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -61.37 -40.85 95.85 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.53 1.132 . . . . 0.0 113.352 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 4.1 pp -86.69 -16.2 37.23 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 -38.64 10.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.214 1.006 . . . . 0.0 112.154 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.0 t -62.28 -33.75 75.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.796 1.238 . . . . 0.0 112.133 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -70.22 -37.1 74.95 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -62.69 -59.62 4.64 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.778 0.717 . . . . 0.0 112.21 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.6 t -139.34 129.38 25.09 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.629 1.172 . . . . 0.0 109.092 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 7.1 t -101.36 166.49 10.72 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.33 1.052 . . . . 0.0 111.076 175.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.7 p -167.77 123.48 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 126.375 1.87 . . . . 0.0 109.249 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 116.688 -1.625 . . . . 0.0 110.225 173.119 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 m120 63.34 31.65 15.12 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.426 1.09 . . . . 0.0 112.859 174.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.53 -164.23 27.88 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 124.871 1.224 . . . . 0.0 112.671 -173.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.5 m -134.99 87.62 2.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.63 1.572 . . . . 0.0 109.085 176.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.0 t -124.31 26.44 7.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.806 1.642 . . . . 0.0 111.42 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -118.44 150.77 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.533 1.533 . . . . 0.0 109.25 -177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.33 168.54 1.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.755 2.022 . . . . 0.0 112.327 174.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -68.78 -15.85 63.63 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.39 -43.27 67.72 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.771 1.628 . . . . 0.0 112.627 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.21 -49.38 69.54 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.498 1.119 . . . . 0.0 111.723 174.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.4 mt -61.86 -43.28 99.17 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.152 1.381 . . . . 0.0 111.063 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -56.78 -60.78 3.06 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 123.094 0.558 . . . . 0.0 110.159 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -59.15 -32.89 72.54 Favored Glycine 0 CA--C 1.541 1.708 0 CA-C-N 118.565 0.62 . . . . 0.0 113.866 178.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.59 -65.31 0.69 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.072 1.349 . . . . 0.0 112.451 175.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 49' ' ' VAL . 11.6 p -68.98 -26.43 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.678 -178.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -56.14 -65.17 0.65 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.649 1.18 . . . . 0.0 111.122 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 m -148.53 38.59 0.86 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -130.61 -62.24 0.92 Allowed 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.636 -0.665 . . . . 0.0 111.441 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 45' ' ' VAL . 2.9 p -67.02 -42.02 88.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.233 -0.292 . . . . 0.0 110.85 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.9 t -63.02 -38.01 89.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.423 1.089 . . . . 0.0 111.364 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 54' ' ' LEU . 13.4 tt0 -63.3 -32.36 73.75 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.868 0.867 . . . . 0.0 111.848 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.87 -48.44 81.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.712 0.805 . . . . 0.0 111.809 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.4 mp -58.01 -51.85 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.483 0.713 . . . . 0.0 109.807 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.2 mt -55.36 -52.22 64.24 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.356 1.063 . . . . 0.0 111.055 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.17 -47.83 80.25 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.22 1.008 . . . . 0.0 111.155 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.54 -43.62 97.43 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.199 0.904 . . . . 0.0 113.066 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' ILE . 80.1 t -60.93 -61.54 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.14 0.976 . . . . 0.0 110.827 178.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -57.69 -36.7 72.32 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.298 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.4 m -63.66 -54.43 35.76 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 124.153 0.981 . . . . 0.0 111.421 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.39 -44.57 89.88 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 119.11 0.868 . . . . 0.0 112.728 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.71 -54.21 25.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 117.573 0.686 . . . . 0.0 112.288 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -37.36 78.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.852 0.861 . . . . 0.0 112.14 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.58 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -58.32 -57.77 11.45 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.376 1.071 . . . . 0.0 110.85 171.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 67' ' ' ILE . 3.2 tt -52.61 -50.79 62.37 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.564 0.62 . . . . 0.0 112.554 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.2 t -60.57 -41.21 94.18 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.071 0.396 . . . . 0.0 111.946 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -63.46 -38.54 91.54 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.851 -1.156 . . . . 0.0 111.789 176.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 64' ' ' LEU . 25.8 mt -59.48 -56.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.343 0.322 0 C-N-CA 124.047 0.939 . . . . 0.0 108.813 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.559 ' O ' HG22 ' A' ' 72' ' ' THR . 27.3 m -59.38 -42.68 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.78 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.7 t -54.13 -49.11 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.139 0.881 . . . . 0.0 110.665 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -69.72 -29.18 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 175.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.2 mt -66.76 -45.53 87.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 120.039 1.291 . . . . 0.0 111.792 176.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.559 HG22 ' O ' ' A' ' 68' ' ' VAL . 3.4 t -92.16 -53.92 4.04 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.2 m -82.49 -36.67 26.25 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.305 1.042 . . . . 0.0 111.766 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.12 74.62 0.4 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.288 1.835 . . . . 0.0 111.734 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.23 133.75 50.33 Favored 'General case' 0 C--O 1.24 0.574 0 O-C-N 121.27 -0.894 . . . . 0.0 110.92 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.44 -24.75 62.95 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.83 1.252 . . . . 0.0 113.511 172.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -86.77 57.3 4.42 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.233 1.813 . . . . 0.0 110.571 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.81 103.08 19.68 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 124.246 1.018 . . . . 0.0 111.361 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.63 113.82 2.87 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.126 2.551 . . . . 0.0 111.493 177.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 7.4 pt -47.87 -34.16 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.173 1.389 . . . . 0.0 113.833 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.56 -49.27 76.93 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.468 1.107 . . . . 0.0 111.178 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mt -59.73 -52.34 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.616 1.167 . . . . 0.0 110.12 172.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.4 mm -58.06 -42.64 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.609 0.64 . . . . 0.0 111.021 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -64.56 -48.72 73.97 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.538 0.735 . . . . 0.0 112.809 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -56.02 -55.67 30.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.354 0.525 . . . . 0.0 111.83 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.0 m -63.05 -42.57 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.328 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 30.5 t -53.11 -58.95 5.26 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.152 0.981 . . . . 0.0 111.147 176.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 16.4 mt -53.15 -52.88 57.33 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-O 119.047 -0.501 . . . . 0.0 110.928 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.44 -44.87 72.87 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -56.28 -54.86 40.37 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.39 1.476 . . . . 0.0 112.022 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.0 mt -64.24 -48.29 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 119.288 -0.387 . . . . 0.0 111.144 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 59.0 mt -56.54 -46.5 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.881 0.872 . . . . 0.0 110.13 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.3 tp -53.03 -58.17 7.91 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.68 1.192 . . . . 0.0 111.057 172.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.624 ' HA ' HD23 ' A' ' 97' ' ' LEU . 2.7 t60 -58.18 -48.73 79.38 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.178 0.444 . . . . 0.0 111.451 -176.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.2 t -60.28 -47.86 84.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.239 1.016 . . . . 0.0 111.963 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.15 84.93 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.631 0.772 . . . . 0.0 112.147 173.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.624 HD23 ' HA ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -57.32 -39.53 76.02 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.948 0.499 . . . . 0.0 110.916 174.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -63.87 -52.69 58.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.836 0.454 . . . . 0.0 110.762 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -57.6 -46.24 84.31 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.934 175.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.79 90.72 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.821 0.737 . . . . 0.0 111.93 176.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.93 -41.31 91.53 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.703 0.683 . . . . 0.0 111.727 -178.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.58 -47.16 73.62 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.686 0.394 . . . . 0.0 111.568 174.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.14 -34.63 78.47 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.508 -0.745 . . . . 0.0 112.316 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.5 m -58.91 -18.18 31.01 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.643 1.577 . . . . 0.0 113.755 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -102.95 -27.84 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.75 -44.2 74.24 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 176.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 88.3 p -138.52 -178.07 5.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 110.482 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 69.4 m 62.88 19.82 11.79 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.8 m -138.49 105.31 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.59 1.956 . . . . 0.0 110.439 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.039 173.414 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.218 0 CA-C-O 117.953 -1.471 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -141.3 139.71 33.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.559 1.18 . . . . 0.0 108.514 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.74 -177.74 39.42 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.276 0.941 . . . . 0.0 112.821 175.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.8 t -114.57 86.59 2.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.0 0.92 . . . . 0.0 110.719 -176.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.1 t -128.1 30.63 5.2 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.052 1.741 . . . . 0.0 112.609 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mp -99.86 154.31 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.648 1.179 . . . . 0.0 109.196 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.02 173.75 1.77 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.116 1.366 . . . . 0.0 111.699 174.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -68.6 -16.24 63.79 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.17 -40.82 78.05 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.487 1.115 . . . . 0.0 112.207 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.8 -51.21 58.11 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.488 1.115 . . . . 0.0 111.2 172.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.71 -46.24 89.69 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.133 1.373 . . . . 0.0 111.017 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -56.86 -62.8 1.49 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.296 0.639 . . . . 0.0 110.45 176.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.37 -33.22 70.13 Favored Glycine 0 CA--C 1.539 1.568 0 CA-C-N 118.356 0.526 . . . . 0.0 113.687 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 HG21 ' A' ' 48' ' ' THR . 14.7 mt -60.23 -67.52 0.38 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.78 1.232 . . . . 0.0 112.281 175.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.0 -26.6 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 O-C-N 121.789 -0.569 . . . . 0.0 112.142 -177.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -56.16 -64.56 0.82 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.679 1.191 . . . . 0.0 111.945 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.0 m -147.65 38.08 0.92 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 HD23 ' A' ' 44' ' ' LEU . 6.8 m -129.89 -53.46 1.14 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.593 0.757 . . . . 0.0 111.61 178.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.415 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -72.1 -51.49 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.367 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.9 t -49.06 -41.33 34.8 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 111.981 -176.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.504 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.8 tm0? -62.38 -37.98 87.81 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.0 112.646 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.8 94.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.811 1.244 . . . . 0.0 112.349 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.449 ' O ' HG23 ' A' ' 57' ' ' VAL . 4.5 mp -59.2 -55.52 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.351 0.66 . . . . 0.0 109.817 174.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 51' ' ' GLN . 17.5 mt -54.38 -47.57 72.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.959 0.904 . . . . 0.0 111.455 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.41 -55.07 37.97 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 125.39 1.476 . . . . 0.0 110.568 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.14 -42.11 54.64 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 119.012 0.824 . . . . 0.0 113.699 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 53' ' ' ILE . 99.4 t -60.3 -64.23 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.438 1.095 . . . . 0.0 110.899 177.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -60.02 -34.18 73.02 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 117.518 -1.229 . . . . 0.0 111.923 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 m -57.91 -59.11 5.75 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.986 1.314 . . . . 0.0 111.609 173.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -60.55 -43.75 98.53 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.554 0.615 . . . . 0.0 112.66 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.89 66.38 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 117.41 0.605 . . . . 0.0 112.097 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.7 -38.75 78.97 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.485 1.114 . . . . 0.0 111.863 176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB1' HG13 ' A' ' 86' ' ' VAL . . . -62.8 -53.1 59.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 121.569 -0.707 . . . . 0.0 112.817 172.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -53.12 -50.2 64.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.146 178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.3 t -60.55 -41.7 95.06 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.431 -0.795 . . . . 0.0 112.046 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.21 -39.18 91.92 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.866 1.212 . . . . 0.0 111.942 177.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 36.5 mt -68.1 -56.91 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 72' ' ' THR . 7.7 p -56.82 -51.32 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 118.647 -0.692 . . . . 0.0 111.499 178.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 66' ' ' LEU . 2.7 p -58.94 -37.34 66.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.043 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 20.4 t-105 -63.89 -38.55 91.52 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.349 0.977 . . . . 0.0 112.534 175.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.03 -39.65 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 118.815 0.734 . . . . 0.0 112.263 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -100.74 -62.71 1.21 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.559 1.144 . . . . 0.0 112.915 -175.579 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.0 t -62.41 -20.9 64.94 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.394 1.077 . . . . 0.0 112.612 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.44 57.43 3.89 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 126.035 1.734 . . . . 0.0 111.774 177.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.26 -76.55 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.005 1.322 . . . . 0.0 112.133 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -161.27 165.24 29.5 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.781 1.632 . . . . 0.0 110.055 175.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -45.47 97.78 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.649 1.98 . . . . 0.0 111.737 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.8 t -73.98 141.88 78.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.468 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.54 131.53 21.73 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.237 1.958 . . . . 0.0 110.673 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 16.5 pt -49.92 -42.68 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.548 1.139 . . . . 0.0 112.292 175.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -41.88 70.73 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.224 1.41 . . . . 0.0 112.4 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' HG23 ' A' ' 86' ' ' VAL . 11.4 mm -63.21 -60.15 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.684 0.794 . . . . 0.0 109.487 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 41.0 mm -57.17 -40.94 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-N 118.745 0.702 . . . . 0.0 111.955 -174.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -57.96 -54.9 41.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.08 0.952 . . . . 0.0 111.882 173.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -54.62 -40.21 68.69 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.251 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG13 ' HB1' ' A' ' 63' ' ' ALA . 59.0 t -59.47 -67.06 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 124.142 0.977 . . . . 0.0 110.841 177.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -48.23 75.48 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.193 0.906 . . . . 0.0 111.167 -176.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -52.87 -53.03 54.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.427 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.04 -44.19 78.55 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.966 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.56 -55.61 27.54 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.958 1.253 . . . . 0.0 112.5 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 4.0 mp -64.35 -50.07 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 76.6 mt -55.81 -42.41 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.581 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp -55.04 -59.82 4.23 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.137 1.775 . . . . 0.0 110.969 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -60.31 -47.99 83.68 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.393 0.542 . . . . 0.0 111.573 -175.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 18.7 m -59.25 -52.93 63.56 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.668 0.787 . . . . 0.0 111.633 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -42.75 88.84 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 117.678 -1.153 . . . . 0.0 112.269 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.18 -62.31 1.85 Allowed 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.808 1.243 . . . . 0.0 110.569 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -56.86 -39.05 73.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.202 0.455 . . . . 0.0 112.112 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -55.53 -64.78 0.74 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.011 0.925 . . . . 0.0 110.753 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -60.75 -35.77 77.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.76 0.709 . . . . 0.0 111.272 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -56.01 -38.59 70.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.403 1.481 . . . . 0.0 113.149 173.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.68 -36.95 14.94 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.723 0.692 . . . . 0.0 111.924 178.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -48.33 68.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.475 1.51 . . . . 0.0 112.331 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.3 m -62.46 -21.63 65.6 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.828 0.851 . . . . 0.0 112.728 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -89.6 -34.88 16.16 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.108 0.963 . . . . 0.0 112.381 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.57 -64.67 0.87 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.981 1.312 . . . . 0.0 112.671 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -77.07 77.65 3.61 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.181 0.593 . . . . 0.0 110.644 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 62.8 m -73.13 116.96 14.28 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.39 1.076 . . . . 0.0 111.777 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.22 94.24 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.836 1.254 . . . . 0.0 109.626 176.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.82 1.648 . . . . 0.0 112.493 169.994 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.23 172.25 13.19 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.067 1.747 . . . . 0.0 110.001 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.32 161.01 38.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.375 0.512 . . . . 0.0 113.375 175.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.9 m -100.99 75.41 1.67 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.443 1.097 . . . . 0.0 111.188 -174.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.3 t -139.75 35.5 1.99 Allowed 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 122.369 1.08 . . . . 0.0 112.494 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -99.64 155.08 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.199 -0.938 . . . . 0.0 109.079 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.01 175.62 0.67 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.323 1.849 . . . . 0.0 112.111 174.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -68.94 -15.02 63.38 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.18 -1.575 . . . . 0.0 114.135 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -43.44 84.84 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.392 1.077 . . . . 0.0 112.15 -177.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -52.77 -43.15 65.62 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.423 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.1 mt -62.67 -47.05 85.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.262 1.425 . . . . 0.0 111.117 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -57.9 -59.23 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.835 0.854 . . . . 0.0 109.785 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.03 -31.9 74.03 Favored Glycine 0 CA--C 1.543 1.83 0 CA-C-N 118.381 0.537 . . . . 0.0 114.038 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.0 mt -61.8 -66.44 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.237 1.415 . . . . 0.0 111.69 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 m -66.5 -24.94 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 119.057 -0.496 . . . . 0.0 112.024 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.64 -63.28 1.29 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.937 1.295 . . . . 0.0 111.467 173.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.4 p -150.59 40.02 0.74 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -172.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.9 m -131.82 -50.79 0.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.845 0.858 . . . . 0.0 112.008 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' HD12 ' A' ' 53' ' ' ILE . 2.6 t -75.78 -50.02 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.367 175.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -49.43 -40.73 37.69 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 118.984 0.811 . . . . 0.0 112.139 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.48 ' HA ' HD12 ' A' ' 54' ' ' LEU . 50.5 mt-30 -64.06 -35.07 79.54 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.35 1.06 . . . . 0.0 113.53 175.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.96 -43.46 98.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.835 0.854 . . . . 0.0 111.62 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 49' ' ' VAL . 3.9 mp -60.97 -52.66 59.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.359 0.663 . . . . 0.0 110.251 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 51' ' ' GLN . 7.9 mt -60.29 -52.27 65.97 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.832 0.853 . . . . 0.0 110.557 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -54.88 -55.86 25.86 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.248 1.019 . . . . 0.0 110.123 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.08 -39.23 91.79 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 118.764 -1.02 . . . . 0.0 113.613 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.42 -62.72 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.579 1.19 . . . . 0.0 110.531 173.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -64.27 -52.5 58.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.872 -173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 m -58.98 -37.49 76.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.387 1.075 . . . . 0.0 112.086 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -58.17 11.35 Favored Glycine 0 CA--C 1.525 0.679 0 C-N-CA 124.156 0.884 . . . . 0.0 113.35 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.25 -39.86 73.24 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 117.112 0.456 . . . . 0.0 111.936 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -46.05 90.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.75 0.82 . . . . 0.0 112.146 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.587 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -61.77 -45.72 92.67 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.078 0.854 . . . . 0.0 112.133 174.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -54.24 -54.04 45.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 118.742 -0.646 . . . . 0.0 111.469 176.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.5 t -61.95 -37.31 84.26 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.129 0.422 . . . . 0.0 111.522 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.587 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -63.2 -41.24 99.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.48 0.582 . . . . 0.0 111.427 176.07 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 86' ' ' VAL . 29.5 mt -67.6 -56.3 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 O-C-N 121.371 -0.831 . . . . 0.0 109.534 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 72' ' ' THR . 7.4 p -55.0 -51.52 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 118.133 -0.937 . . . . 0.0 111.762 177.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 66' ' ' LEU . 3.7 p -59.81 -40.74 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 118.753 0.706 . . . . 0.0 111.204 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -62.14 -39.73 93.58 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 117.943 -1.027 . . . . 0.0 111.568 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 67' ' ' ILE . 1.3 mp -66.4 -62.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.841 0.856 . . . . 0.0 110.923 175.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 68' ' ' VAL . 6.1 t -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.498 0.719 . . . . 0.0 112.52 -174.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.8 t -75.26 -13.51 60.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.72 0.808 . . . . 0.0 112.394 176.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 48.87 59.5 4.37 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 126.349 1.86 . . . . 0.0 111.286 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.43 142.14 39.65 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.415 -177.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.11 -69.44 0.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.239 1.016 . . . . 0.0 111.368 -173.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -143.61 164.99 28.84 Favored 'General case' 0 C--N 1.335 -0.034 0 C-N-CA 125.919 1.687 . . . . 0.0 108.589 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.799 HG21 HD11 ' A' ' 83' ' ' ILE . 5.9 t -129.0 139.81 36.79 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 124.977 1.311 . . . . 0.0 109.542 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -68.22 145.5 66.54 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.432 2.088 . . . . 0.0 110.8 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 22.8 pt -49.12 -41.09 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.138 0.975 . . . . 0.0 112.344 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -60.17 -42.1 94.25 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.337 1.055 . . . . 0.0 112.305 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.456 HG23 HD21 ' A' ' 66' ' ' LEU . 6.4 mt -58.79 -55.17 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.961 0.904 . . . . 0.0 109.734 172.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.799 HD11 HG21 ' A' ' 78' ' ' THR . 49.4 mm -63.82 -34.02 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.776 -0.577 . . . . 0.0 111.682 -175.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.09 -61.92 2.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.478 1.111 . . . . 0.0 110.337 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -57.14 -37.89 72.71 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-O 118.453 -0.784 . . . . 0.0 112.131 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.648 HG13 HD11 ' A' ' 67' ' ' ILE . 55.3 t -58.21 -63.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.118 0.967 . . . . 0.0 110.142 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.626 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.3 OUTLIER -59.33 -48.86 80.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.926 -176.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.01 -55.19 22.04 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.462 0.705 . . . . 0.0 111.288 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -52.33 -45.84 65.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.986 0.914 . . . . 0.0 112.63 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -56.04 -53.39 57.52 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.556 0.742 . . . . 0.0 111.946 176.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -61.34 -50.98 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.468 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.5 mt -53.8 -43.96 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.814 0.846 . . . . 0.0 110.049 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 mt -57.62 -55.26 37.18 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 117.772 -1.109 . . . . 0.0 111.428 172.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -55.24 -50.57 69.11 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.527 1.058 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 m -61.76 -49.25 77.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.761 0.825 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.05 -46.73 87.84 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.362 0.665 . . . . 0.0 112.089 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.578 HD23 ' HE2' ' A' ' 100' ' ' LYS . 49.1 mt -56.37 -41.59 76.46 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.394 1.477 . . . . 0.0 111.032 174.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -56.61 12.31 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.823 0.738 . . . . 0.0 111.097 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -54.64 -48.43 72.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.411 0.551 . . . . 0.0 112.1 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.578 ' HE2' HD23 ' A' ' 97' ' ' LEU . 20.9 pttt -63.45 -38.52 91.47 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.076 176.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -62.94 -38.42 90.95 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.442 1.019 . . . . 0.0 111.564 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.5 mt -68.65 -51.32 43.35 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.82 0.448 . . . . 0.0 111.778 174.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -36.16 82.84 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 118.169 0.441 . . . . 0.0 111.829 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 41.6 t -60.47 -49.5 77.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.35 1.46 . . . . 0.0 111.151 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -61.58 -43.19 99.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -59.71 -33.13 71.21 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.6 m -104.95 76.89 1.28 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.631 1.572 . . . . 0.0 112.172 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.56 14.5 11.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.225 1.01 . . . . 0.0 113.417 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.2 p -167.86 123.76 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.099 2.16 . . . . 0.0 109.082 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 116.671 -1.633 . . . . 0.0 110.278 171.782 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 CA-C-O 119.237 -0.757 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -158.84 113.01 2.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.186 0.994 . . . . 0.0 110.908 170.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -172.62 175.64 45.67 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.221 0.915 . . . . 0.0 112.725 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.9 p -111.68 71.65 0.75 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.224 1.81 . . . . 0.0 111.285 -173.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.3 t -129.18 27.91 5.32 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.846 1.258 . . . . 0.0 112.91 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.2 mm -72.61 157.08 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.593 0.711 . . . . 0.0 110.398 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.1 157.44 6.01 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.481 1.913 . . . . 0.0 112.321 174.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -64.26 -16.74 62.69 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -53.12 -57.66 9.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.756 1.622 . . . . 0.0 110.593 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.26 -34.29 77.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.259 1.024 . . . . 0.0 111.599 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HA ' HD23 ' A' ' 44' ' ' LEU . 6.4 mp -64.33 -56.16 16.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 111.721 175.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -54.91 -43.36 73.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.081 0.552 . . . . 0.0 109.868 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.92 -44.12 96.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 123.954 0.787 . . . . 0.0 114.483 175.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -59.42 -39.82 84.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.666 1.233 . . . . 0.0 111.232 177.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.2 t -81.46 -28.19 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.69 -0.672 . . . . 0.0 112.301 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.99 -58.89 5.45 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.327 1.451 . . . . 0.0 111.368 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 m -159.76 43.62 0.22 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.943 0.897 . . . . 0.0 113.133 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m -125.22 -66.51 0.95 Allowed 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.149 -0.969 . . . . 0.0 110.904 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.05 -43.61 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.683 -0.636 . . . . 0.0 111.583 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.8 t -62.37 -37.85 87.3 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.259 1.024 . . . . 0.0 111.029 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -67.93 -34.18 76.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.219 1.008 . . . . 0.0 111.733 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.88 99.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.989 0.813 . . . . 0.0 112.49 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.9 mt -61.75 -65.13 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.437 0.695 . . . . 0.0 109.752 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 pp -54.84 -35.94 64.5 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.335 0.654 . . . . 0.0 112.358 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -56.76 -57.81 10.82 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.281 1.033 . . . . 0.0 110.661 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.45 -35.21 84.39 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 118.389 -1.228 . . . . 0.0 113.207 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.7 t -57.12 -65.61 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 118.576 1.188 . . . . 0.0 111.032 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -60.83 -43.32 98.4 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.956 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.5 m -60.29 -50.81 72.18 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.71 0.687 . . . . 0.0 111.965 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.74 -47.51 88.47 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.35 0.523 . . . . 0.0 112.676 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.06 -49.43 77.68 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 117.651 0.725 . . . . 0.0 112.235 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.45 -41.08 79.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.955 0.902 . . . . 0.0 111.926 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -59.32 -54.07 50.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.314 0.506 . . . . 0.0 111.276 172.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 tt -51.65 -52.72 45.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.909 0.884 . . . . 0.0 112.885 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 69' ' ' VAL . 10.1 t -60.19 -41.75 93.59 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.629 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -62.51 -42.79 99.75 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.06 0.845 . . . . 0.0 111.023 176.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.622 ' CD1' HD11 ' A' ' 90' ' ' LEU . 23.7 mt -56.11 -57.37 8.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 123.917 0.887 . . . . 0.0 109.355 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.412 ' O ' HG22 ' A' ' 72' ' ' THR . 30.7 m -58.47 -43.67 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.315 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 65' ' ' THR . 65.1 t -54.15 -43.75 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 119.268 0.94 . . . . 0.0 110.882 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -72.08 -24.62 61.53 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.37 -34.43 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 119.813 1.188 . . . . 0.0 111.933 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -105.22 -62.52 1.34 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.146 0.979 . . . . 0.0 112.201 -178.228 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.7 t -72.22 -28.36 63.12 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.805 1.242 . . . . 0.0 112.554 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 54.42 49.12 19.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.551 1.54 . . . . 0.0 111.623 177.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.01 171.79 1.16 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.382 1.086 . . . . 0.0 112.748 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -158.53 98.8 1.55 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.854 1.262 . . . . 0.0 110.135 -174.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.96 -33.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.4 154.14 73.38 Favored Pre-proline 0 N--CA 1.466 0.374 0 C-N-CA 124.679 1.192 . . . . 0.0 111.622 175.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.65 128.92 19.96 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.664 2.243 . . . . 0.0 110.829 -179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 18.5 pt -48.83 -37.99 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.524 1.13 . . . . 0.0 112.768 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.78 -41.58 82.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.353 1.061 . . . . 0.0 111.61 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -65.29 -54.33 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 C-N-CA 123.711 0.804 . . . . 0.0 110.398 175.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -58.19 -41.71 81.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.062 0.545 . . . . 0.0 111.147 -177.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -66.64 -46.58 75.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.486 0.714 . . . . 0.0 111.756 175.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -54.74 -56.36 20.06 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.806 0.73 . . . . 0.0 111.72 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m -60.23 -43.57 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.963 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.587 ' O ' HD12 ' A' ' 91' ' ' ILE . 31.0 t -53.19 -56.88 12.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.916 0.887 . . . . 0.0 111.5 178.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.43 -51.09 69.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.924 -0.56 . . . . 0.0 110.984 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -52.96 -45.38 67.71 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.083 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.622 HD11 ' CD1' ' A' ' 67' ' ' ILE . 45.6 mt -57.06 -53.26 60.05 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.17 0.988 . . . . 0.0 112.016 177.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.587 HD12 ' O ' ' A' ' 87' ' ' SER . 3.4 mt -63.7 -49.23 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.485 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.01 -43.94 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.8 0.84 . . . . 0.0 110.475 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -55.33 -58.53 7.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.75 1.22 . . . . 0.0 111.003 170.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.0 -44.95 87.5 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.3 0.5 . . . . 0.0 111.781 -176.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -58.66 -55.86 29.58 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 124.75 1.22 . . . . 0.0 111.592 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.17 89.11 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.841 0.746 . . . . 0.0 112.156 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.24 -53.18 61.24 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.612 0.765 . . . . 0.0 111.663 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -46.22 91.51 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.018 0.826 . . . . 0.0 111.11 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -56.67 -51.6 68.14 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.188 0.995 . . . . 0.0 112.151 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -66.48 -33.58 76.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 118.294 -0.86 . . . . 0.0 112.502 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -61.59 -51.75 67.26 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.494 1.518 . . . . 0.0 111.206 175.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 103' ' ' LEU . 4.2 pp -69.45 -34.17 74.02 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 118.865 -0.588 . . . . 0.0 112.363 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -76.03 -36.41 59.12 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.719 0.69 . . . . 0.0 111.093 178.744 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.6 m -62.62 -40.05 95.74 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.112 0.965 . . . . 0.0 112.383 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -79.23 -18.8 52.15 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -44.3 96.66 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.321 0.964 . . . . 0.0 111.374 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -146.59 123.91 11.6 Favored 'General case' 0 C--N 1.338 0.077 0 C-N-CA 123.142 0.577 . . . . 0.0 111.757 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 61.5 m -91.16 14.81 13.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.979 1.311 . . . . 0.0 113.074 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -140.86 101.15 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.806 1.642 . . . . 0.0 111.117 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 116.807 -1.568 . . . . 0.0 110.506 172.264 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.069 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -93.25 -71.6 0.65 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 117.664 0.732 . . . . 0.0 110.198 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.23 -172.67 37.02 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.715 1.15 . . . . 0.0 113.071 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.9 p -115.07 77.3 1.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.185 1.794 . . . . 0.0 110.712 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.0 t -127.11 26.71 6.03 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.489 1.516 . . . . 0.0 112.542 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.1 mp -86.25 156.17 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 121.441 0.638 . . . . 0.0 109.465 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -178.69 0.39 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.148 1.779 . . . . 0.0 112.128 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -85.66 -10.85 55.12 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.86 -1.15 . . . . 0.0 112.751 178.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -55.39 -37.12 67.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.62 1.568 . . . . 0.0 112.932 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -53.23 -51.9 60.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.084 0.953 . . . . 0.0 110.957 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.09 -43.48 98.75 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 125.582 1.553 . . . . 0.0 111.492 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -56.11 -64.04 0.99 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.793 0.837 . . . . 0.0 110.553 175.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.46 -33.61 66.73 Favored Glycine 0 CA--C 1.539 1.585 0 CA-C-N 118.306 0.503 . . . . 0.0 113.183 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.73 -66.04 0.54 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.451 1.501 . . . . 0.0 112.712 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.462 ' HA ' HG12 ' A' ' 49' ' ' VAL . 8.7 p -65.19 -24.45 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 121.696 -0.628 . . . . 0.0 111.88 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -61.88 -55.03 33.96 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.773 0.829 . . . . 0.0 112.648 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.0 m -158.36 46.91 0.34 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.104 0.865 . . . . 0.0 113.134 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.7 m -135.85 -58.42 0.77 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.845 0.858 . . . . 0.0 110.587 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.462 HG12 ' HA ' ' A' ' 45' ' ' VAL . 1.7 p -67.01 -40.17 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.156 0.434 . . . . 0.0 111.066 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 t -65.03 -36.78 85.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.886 0.874 . . . . 0.0 111.137 -177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.622 ' HA ' HD12 ' A' ' 54' ' ' LEU . 0.9 OUTLIER -64.48 -30.86 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.874 0.87 . . . . 0.0 111.767 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.03 71.44 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.228 1.011 . . . . 0.0 111.876 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 3.3 mp -56.94 -51.66 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.574 0.749 . . . . 0.0 109.65 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 51' ' ' GLN . 12.0 mt -55.58 -53.41 56.77 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.182 0.993 . . . . 0.0 110.352 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -55.19 -50.82 68.39 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.586 1.154 . . . . 0.0 111.513 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.99 -42.41 86.77 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.222 -0.766 . . . . 0.0 112.944 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 53' ' ' ILE . 92.3 t -62.3 -62.76 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.166 0.983 . . . . 0.0 111.184 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -55.89 -41.22 74.15 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.853 0.461 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.7 t -61.79 -49.75 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.912 1.285 . . . . 0.0 111.108 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -56.56 -50.21 64.53 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 123.66 0.647 . . . . 0.0 112.668 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.79 -49.46 76.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 117.527 0.664 . . . . 0.0 112.322 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.52 -40.18 78.2 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.32 0.648 . . . . 0.0 111.827 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.714 ' HA ' HD23 ' A' ' 66' ' ' LEU . . . -64.25 -49.52 71.59 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.158 0.583 . . . . 0.0 112.187 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.3 tt -49.64 -58.6 4.96 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.651 0.78 . . . . 0.0 111.485 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.5 t -56.61 -43.21 79.94 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.434 -0.794 . . . . 0.0 111.851 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.714 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.17 -42.71 69.93 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 124.601 1.16 . . . . 0.0 111.176 176.435 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.07 -46.52 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 64' ' ' LEU . 4.1 t -58.85 -51.08 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.943 0.497 . . . . 0.0 110.655 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 12.7 p -62.1 -42.38 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.542 0.737 . . . . 0.0 111.563 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.475 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 14.8 t90 -62.41 -39.33 92.9 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.577 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 mp -66.82 -56.02 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 118.883 0.765 . . . . 0.0 110.606 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.8 t -66.96 -46.34 74.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.413 0.685 . . . . 0.0 112.32 -176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.5 t -78.57 -8.83 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.511 1.124 . . . . 0.0 112.43 177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 50.57 40.72 24.31 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.193 1.797 . . . . 0.0 112.28 -176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.8 t -53.88 109.78 0.51 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.385 0.674 . . . . 0.0 112.139 -172.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -15.01 11.94 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.413 1.085 . . . . 0.0 113.708 -176.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -28.97 70.06 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.276 1.031 . . . . 0.0 111.763 175.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.69 142.85 91.81 Favored Pre-proline 0 N--CA 1.454 -0.258 0 C-N-CA 125.643 1.577 . . . . 0.0 110.99 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 82' ' ' ILE . 37.2 Cg_endo -65.16 127.36 18.2 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.263 2.642 . . . . 0.0 111.06 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 10.4 pt -49.77 -39.21 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.294 1.038 . . . . 0.0 112.875 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -56.72 -41.89 78.25 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.2 1.0 . . . . 0.0 111.897 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.553 ' O ' HG23 ' A' ' 86' ' ' VAL . 1.6 mp -63.7 -57.03 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 C-N-CA 124.06 0.944 . . . . 0.0 108.988 175.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.475 HG21 ' CZ2' ' A' ' 70' ' ' TRP . 37.2 mm -59.29 -41.66 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.865 0.364 . . . . 0.0 111.764 -174.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -59.97 -51.3 70.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.481 0.713 . . . . 0.0 111.398 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.2 -41.42 71.96 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.738 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 82' ' ' ILE . 94.2 t -58.24 -62.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 118.961 0.801 . . . . 0.0 110.267 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.632 ' O ' HD12 ' A' ' 91' ' ' ILE . 9.4 t -57.34 -53.54 56.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 119.575 -0.25 . . . . 0.0 111.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.6 mt -50.62 -52.89 35.29 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 118.806 -0.616 . . . . 0.0 111.472 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -51.9 -45.18 64.09 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.693 0.797 . . . . 0.0 112.396 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 87' ' ' SER . 18.7 mt -56.84 -51.49 68.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.694 0.798 . . . . 0.0 111.743 177.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' O ' ' A' ' 87' ' ' SER . 2.8 mp -63.39 -51.54 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 119.156 -0.45 . . . . 0.0 110.84 178.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.34 -42.9 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.235 1.014 . . . . 0.0 110.436 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tp -56.17 -62.24 1.85 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.189 0.996 . . . . 0.0 110.794 172.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -54.66 -46.72 74.06 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.234 0.47 . . . . 0.0 111.399 -177.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.4 m -53.72 -54.31 39.79 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.183 1.393 . . . . 0.0 112.059 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.27 -52.28 64.36 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.338 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -43.91 49.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.433 1.093 . . . . 0.0 111.227 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.48 ' CE2' HD11 ' A' ' 102' ' ' LEU . 21.6 t80 -62.78 -47.06 85.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 110.922 -177.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -53.1 -38.95 63.03 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.62 0.368 . . . . 0.0 111.906 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.485 ' HA ' HD23 ' A' ' 103' ' ' LEU . 3.4 mtmt -65.97 -53.64 36.37 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.687 0.795 . . . . 0.0 111.889 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -57.04 -37.69 72.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.218 -0.42 . . . . 0.0 111.75 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.48 HD11 ' CE2' ' A' ' 98' ' ' TYR . 63.8 mt -67.68 -53.28 28.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.632 1.173 . . . . 0.0 112.648 173.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 100' ' ' LYS . 0.3 OUTLIER -59.64 -27.62 66.51 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.66 0.664 . . . . 0.0 111.935 179.009 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 p -51.92 -40.53 60.9 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.098 1.359 . . . . 0.0 112.598 -178.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -79.99 -41.34 26.09 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.35 1.06 . . . . 0.0 111.778 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -53.53 -65.66 0.53 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.412 1.085 . . . . 0.0 112.832 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 10.0 t 174.53 132.64 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.483 1.513 . . . . 0.0 110.415 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.1 t -78.63 127.39 32.05 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.178 0.991 . . . . 0.0 110.907 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.79 86.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.093 1.357 . . . . 0.0 109.543 178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.254 1.294 0 CA-C-O 116.805 -1.569 . . . . 0.0 113.372 173.092 . . . . . . . . 0 0 . 1 stop_ save_