data_2rsx_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 2rsx _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 121.042 0.448 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG23 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.797 0.808 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.442 ' CE1' HG23 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 120.796 0.331 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.407 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.407 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.415 HG23 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 CA--C 1.543 0.678 0 CA-C-O 121.269 0.557 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.126 0.489 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.54 0.558 0 CA-C-O 121.095 0.474 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.411 ' CE1' HG23 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.411 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.024 0.44 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 120.804 0.335 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.481 0.658 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG23 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.438 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . 0.438 ' CZ2' ' HE3' ' A' ' 145' ' ' LYS . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.429 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.543 0.693 0 CA-C-O 121.14 0.495 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 121.155 0.502 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.424 ' CE2' HG23 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.424 HG23 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.41 ' CE1' HG23 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt . . . . . 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.41 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.29 0.566 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 121.602 0.715 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.099 0.476 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.4 ' CE2' HG23 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . 0.45 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.616 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.3 ttpp -152.59 33.52 0.5 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.819 1.247 . . . . 0.0 112.908 -175.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -156.69 143.91 18.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.411 1.484 . . . . 0.0 111.547 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.1 m -141.48 143.89 34.08 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.323 1.849 . . . . 0.0 109.279 -175.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -155.5 163.32 40.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.854 1.262 . . . . 0.0 111.214 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.45 -122.85 6.5 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.81 1.195 . . . . 0.0 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -159.41 -45.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.664 1.185 . . . . 0.0 112.21 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -84.14 136.39 34.0 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.535 1.134 . . . . 0.0 109.49 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt -64.94 134.34 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -174.47 -167.93 34.57 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 126.258 1.885 . . . . 0.0 111.991 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -158.57 152.41 23.54 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.21 1.404 . . . . 0.0 111.663 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.59 151.9 19.85 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.415 1.007 . . . . 0.0 113.249 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -168.59 134.75 1.83 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.717 2.007 . . . . 0.0 109.506 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -108.26 138.97 43.63 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.023 0.929 . . . . 0.0 111.494 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -1.38 6.04 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.039 1.336 . . . . 0.0 114.242 170.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.736 -0.545 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -69.33 138.78 54.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.194 0.998 . . . . 0.0 112.075 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -71.87 -38.3 70.05 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -173.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.5 t -171.04 173.13 5.17 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.759 2.024 . . . . 0.0 110.623 -176.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 m -143.5 -63.08 0.4 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.528 1.531 . . . . 0.0 111.261 176.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 -84.27 0.77 Allowed Glycine 0 CA--C 1.528 0.897 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 -174.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -165.07 -51.81 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.479 1.511 . . . . 0.0 111.888 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt -93.37 127.42 38.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.784 1.234 . . . . 0.0 109.996 175.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG23 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.94 130.53 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.08 -168.12 25.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.706 1.622 . . . . 0.0 112.494 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -156.6 139.57 15.35 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.321 1.448 . . . . 0.0 110.71 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -159.42 145.14 10.98 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.525 1.06 . . . . 0.0 113.07 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -168.66 134.96 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.893 2.077 . . . . 0.0 109.378 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -111.31 139.73 46.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.171 0.988 . . . . 0.0 111.621 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.08 -0.11 5.39 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.092 1.357 . . . . 0.0 114.137 170.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.127 -0.389 . . . . 0.0 112.127 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -141.05 155.75 46.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.716 1.607 . . . . 0.0 111.869 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -77.69 147.08 35.65 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.131 0.972 . . . . 0.0 111.496 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.7 m -141.38 124.93 16.73 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.621 1.568 . . . . 0.0 109.116 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 m -68.17 -9.98 50.85 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -169.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.91 -15.32 79.36 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.088 . . . . 0.0 113.855 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -147.67 -167.39 2.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.91 1.684 . . . . 0.0 111.911 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt -124.39 128.49 49.14 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.34 1.056 . . . . 0.0 112.476 -168.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.442 ' CE1' HG23 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -62.72 133.23 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.63 151.17 22.95 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.485 1.993 . . . . 0.0 111.319 170.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -72.73 -40.12 66.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.583 0.691 . . . . 0.0 112.83 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.2 94.83 0.08 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.29 1.9 . . . . 0.0 114.326 170.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -167.09 158.28 12.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.832 1.653 . . . . 0.0 111.655 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -143.88 142.31 30.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.547 1.139 . . . . 0.0 110.623 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -6.4 25.49 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 171.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -71.97 -27.25 62.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -176.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.3 t30 71.58 136.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.288 2.635 . . . . 0.0 113.251 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.4 t -168.87 172.76 7.51 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.162 2.185 . . . . 0.0 110.293 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -142.86 6.49 1.6 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.914 1.686 . . . . 0.0 113.758 -176.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -83.96 -8.76 83.65 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.591 1.091 . . . . 0.0 114.771 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -102.05 160.17 14.73 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.669 1.588 . . . . 0.0 112.74 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.79 133.34 34.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 0.0 110.762 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt -67.22 133.44 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -166.9 -165.77 24.86 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 125.726 1.632 . . . . 0.0 112.61 176.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -156.37 140.15 16.12 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.559 1.544 . . . . 0.0 110.535 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -152.71 145.64 13.39 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.453 1.025 . . . . 0.0 113.302 -177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -169.32 150.98 4.41 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.228 2.211 . . . . 0.0 109.588 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -136.07 140.05 43.49 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.468 1.107 . . . . 0.0 111.496 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.71 -3.81 10.35 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.716 1.207 . . . . 0.0 114.088 170.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.407 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.407 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.415 HG23 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? 74.01 121.56 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 128.022 2.529 . . . . 0.0 112.336 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -151.96 139.16 19.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.201 1.4 . . . . 0.0 111.104 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.5 m -150.55 131.74 14.48 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.994 1.718 . . . . 0.0 109.037 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.5 m -161.71 117.5 2.06 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 0.0 110.694 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -102.16 0.3 50.97 Favored Glycine 0 N--CA 1.478 1.436 0 C-N-CA 125.076 1.322 . . . . 0.0 113.853 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -102.6 169.3 8.73 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.119 2.167 . . . . 0.0 113.162 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt -95.1 130.38 41.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.298 1.439 . . . . 0.0 111.262 -169.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.18 134.5 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.51 153.66 24.99 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.451 1.977 . . . . 0.0 111.634 170.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -73.19 -36.17 66.5 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -176.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.72 168.54 34.39 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 125.525 1.536 . . . . 0.0 115.484 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.0 t0 72.26 161.26 0.24 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 128.372 2.669 . . . . 0.0 113.406 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -129.75 155.53 45.77 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.864 1.666 . . . . 0.0 112.006 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -2.2 13.57 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.644 1.177 . . . . 0.0 114.129 170.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -90.69 -20.52 22.38 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.114 0.965 . . . . 0.0 113.578 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -113.08 6.37 17.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.236 1.814 . . . . 0.0 113.914 -177.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -94.09 19.18 9.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.619 1.967 . . . . 0.0 113.429 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.8 p -67.22 -14.18 62.66 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.5 -2.03 68.14 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.31 1.433 . . . . 0.0 114.181 170.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -112.17 161.55 16.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.924 1.69 . . . . 0.0 111.792 -176.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -90.98 139.87 30.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.587 1.155 . . . . 0.0 110.7 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.43 132.46 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -148.84 -143.79 3.84 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.854 1.693 . . . . 0.0 112.079 173.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -149.66 136.42 19.42 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.665 1.586 . . . . 0.0 110.635 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -110.29 -168.33 19.59 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.621 1.105 . . . . 0.0 115.192 -169.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.1 t0 70.85 171.12 0.32 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.911 2.484 . . . . 0.0 112.487 -173.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -145.72 146.91 31.43 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.616 1.167 . . . . 0.0 111.754 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.15 -22.52 66.92 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.395 1.078 . . . . 0.0 112.223 171.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.675 -0.57 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -139.51 155.91 47.25 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.902 1.681 . . . . 0.0 111.648 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -145.86 165.46 28.83 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.805 1.642 . . . . 0.0 111.655 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -155.6 164.44 38.64 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.023 1.729 . . . . 0.0 110.686 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.5 p -168.37 -179.61 4.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.846 1.658 . . . . 0.0 112.064 -169.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.78 -53.84 4.89 Favored Glycine 0 N--CA 1.471 1.009 0 C-N-CA 125.195 1.379 . . . . 0.0 112.661 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.08 175.93 6.68 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.343 1.457 . . . . 0.0 111.683 173.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -116.8 127.95 54.82 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.804 1.642 . . . . 0.0 110.735 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.411 ' CE1' HG23 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -67.47 132.65 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.33 -169.74 18.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.966 1.746 . . . . 0.0 112.324 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -156.81 139.57 15.14 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.107 1.363 . . . . 0.0 111.008 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.82 154.62 13.67 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 124.475 1.036 . . . . 0.0 113.509 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.91 130.31 1.2 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.963 2.105 . . . . 0.0 109.413 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -96.56 132.22 42.38 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.441 0.696 . . . . 0.0 111.747 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.26 -0.38 4.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.585 1.554 . . . . 0.0 114.3 170.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.411 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -157.18 151.3 24.82 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.327 1.451 . . . . 0.0 111.682 -177.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -145.63 160.93 40.96 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.178 1.791 . . . . 0.0 110.564 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.9 t -165.36 163.83 19.82 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.74 1.616 . . . . 0.0 111.359 -175.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -102.8 -7.54 21.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.451 1.5 . . . . 0.0 112.646 169.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -69.31 -21.96 76.07 Favored Glycine 0 N--CA 1.474 1.194 0 C-N-CA 124.643 1.116 . . . . 0.0 113.659 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -158.03 163.25 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.535 2.334 . . . . 0.0 110.116 169.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt -104.79 132.17 51.35 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.306 1.443 . . . . 0.0 111.395 -168.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt -66.43 133.76 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -171.77 -172.14 37.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.266 1.889 . . . . 0.0 111.995 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -158.42 152.22 23.59 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.184 1.394 . . . . 0.0 111.578 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.75 152.65 22.1 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.381 0.991 . . . . 0.0 113.113 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -166.36 132.05 2.36 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.587 1.955 . . . . 0.0 109.405 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -109.36 140.21 43.35 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.247 1.019 . . . . 0.0 111.559 -176.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.26 -16.78 64.3 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.048 1.339 . . . . 0.0 112.992 172.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.181 -0.367 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -147.59 8.78 0.9 Allowed 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.78 162.93 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.835 1.654 . . . . 0.0 112.197 -174.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 97.8 m -79.52 143.44 34.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.48 1.112 . . . . 0.0 109.243 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.3 p -160.51 155.39 24.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.451 1.5 . . . . 0.0 110.693 175.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 77.31 -43.81 2.09 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 125.047 1.308 . . . . 0.0 113.406 -176.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -95.02 161.36 14.17 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.389 1.876 . . . . 0.0 111.804 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -90.08 135.22 33.79 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.277 1.431 . . . . 0.0 110.836 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt -64.12 133.75 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.56 -175.8 43.28 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.001 1.762 . . . . 0.0 112.374 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -160.43 156.38 25.97 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.575 1.55 . . . . 0.0 111.295 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.28 156.18 27.85 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.245 0.926 . . . . 0.0 113.412 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -167.99 149.0 5.14 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.203 2.201 . . . . 0.0 109.706 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -135.22 142.05 45.94 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.573 1.149 . . . . 0.0 111.625 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -2.76 8.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.712 1.205 . . . . 0.0 114.032 169.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.863 -0.495 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -156.13 142.48 18.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.281 1.432 . . . . 0.0 111.588 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 12.6 p-10 -163.99 148.89 10.38 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.987 1.715 . . . . 0.0 111.318 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 m -68.09 -34.12 75.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.073 1.349 . . . . 0.0 112.855 -174.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -161.55 151.72 17.26 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.053 1.341 . . . . 0.0 111.197 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 66.08 -113.65 5.91 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.119 0.866 . . . . 0.0 112.527 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -156.24 -43.71 0.08 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.779 1.231 . . . . 0.0 112.343 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt -88.37 128.22 35.5 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.767 1.227 . . . . 0.0 110.867 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.18 133.31 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -167.3 172.42 42.28 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.184 1.849 . . . . 0.0 112.814 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -163.76 143.8 8.42 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.016 1.726 . . . . 0.0 110.737 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 176.64 170.52 39.29 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.796 0.712 . . . . 0.0 114.704 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -153.0 2.33 0.3 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.231 1.812 . . . . 0.0 113.122 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 60.63 165.9 0.08 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 127.693 2.397 . . . . 0.0 113.836 -169.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.13 0.14 56.39 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.419 1.087 . . . . 0.0 112.304 168.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.805 -0.518 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -85.53 -11.51 53.96 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -65.9 132.74 49.35 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.557 1.143 . . . . 0.0 112.468 179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.4 p -86.72 -35.72 19.08 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.608 1.563 . . . . 0.0 112.762 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.5 t -164.09 143.39 7.73 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.866 1.667 . . . . 0.0 111.275 174.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -103.78 4.93 46.61 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.177 1.37 . . . . 0.0 113.917 175.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -117.51 154.97 30.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.994 1.397 . . . . 0.0 112.611 -172.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.24 146.61 32.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.096 1.359 . . . . 0.0 113.048 -167.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG23 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.56 132.59 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.54 -169.49 32.03 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.731 1.634 . . . . 0.0 112.788 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -157.82 140.79 15.03 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.4 1.48 . . . . 0.0 110.857 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.61 151.69 21.29 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.476 1.036 . . . . 0.0 113.391 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -168.33 136.65 2.25 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.758 2.023 . . . . 0.0 109.757 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -106.98 138.94 42.19 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.189 0.996 . . . . 0.0 111.774 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.46 20.8 0.07 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.441 1.896 . . . . 0.0 114.358 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.438 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . 0.438 ' CZ2' ' HE3' ' A' ' 145' ' ' LYS . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.429 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp 62.66 28.9 16.79 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 125.73 1.612 . . . . 0.0 113.605 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -79.21 -5.61 54.68 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.153 1.381 . . . . 0.0 114.3 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -70.08 160.7 31.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.953 . . . . 0.0 112.241 178.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 t -157.1 158.43 36.39 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.068 1.347 . . . . 0.0 110.964 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.93 -121.21 5.45 Favored Glycine 0 N--CA 1.468 0.806 0 C-N-CA 124.334 0.969 . . . . 0.0 111.008 -171.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -158.8 -42.49 0.06 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.267 1.027 . . . . 0.0 112.822 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -89.26 129.91 35.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.524 1.13 . . . . 0.0 110.383 173.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt -63.95 134.3 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.95 -176.8 48.21 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.229 1.871 . . . . 0.0 112.428 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -161.06 155.6 23.36 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.83 1.652 . . . . 0.0 110.979 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -169.6 162.35 35.85 Favored Glycine 0 CA--C 1.528 0.844 0 CA-C-O 121.82 0.678 . . . . 0.0 114.141 -178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -166.39 170.7 12.74 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.167 2.587 . . . . 0.0 110.174 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -140.67 143.86 35.36 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.18 0.992 . . . . 0.0 111.368 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.72 -3.54 9.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.748 1.219 . . . . 0.0 114.035 169.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -68.47 -10.2 53.88 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -56.82 -17.69 10.2 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.571 1.548 . . . . 0.0 114.556 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.1 p -59.04 -21.19 58.71 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.293 1.437 . . . . 0.0 113.902 170.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.6 m -87.2 -9.82 54.16 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -112.35 -21.48 6.19 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 125.73 1.633 . . . . 0.0 114.376 177.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -96.27 160.39 14.45 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 176.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -88.81 146.33 25.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.32 1.448 . . . . 0.0 110.597 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.424 ' CE2' HG23 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -61.34 132.94 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.27 171.24 42.16 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 126.402 1.954 . . . . 0.0 112.306 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -164.1 158.73 19.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.916 1.687 . . . . 0.0 111.253 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.14 167.04 38.04 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 121.854 0.697 . . . . 0.0 114.341 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -166.11 118.39 1.06 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.359 2.264 . . . . 0.0 108.499 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -77.88 142.9 38.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.39 0.676 . . . . 0.0 111.812 -171.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp -65.62 -7.87 17.32 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.876 1.27 . . . . 0.0 113.724 170.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.424 HG23 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.877 -0.489 . . . . 0.0 111.877 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt 61.82 17.02 8.45 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 126.366 1.867 . . . . 0.0 115.065 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -145.6 141.09 27.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.127 1.771 . . . . 0.0 110.826 -172.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -161.73 43.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 125.498 1.519 . . . . 0.0 111.632 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 t -153.61 162.19 41.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.664 1.185 . . . . 0.0 111.706 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.01 -156.33 26.77 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.008 1.766 . . . . 0.0 112.239 -172.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -160.25 -45.36 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.35 1.06 . . . . 0.0 112.294 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt -82.7 143.29 31.02 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.44 1.096 . . . . 0.0 108.972 168.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt -66.34 134.11 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.31 151.06 22.98 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 126.415 1.959 . . . . 0.0 111.583 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -75.44 -35.78 60.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -175.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.21 171.9 39.05 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.667 1.603 . . . . 0.0 115.782 170.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 t0 73.19 159.81 0.22 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.705 2.802 . . . . 0.0 113.227 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -127.68 156.27 42.62 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.877 1.671 . . . . 0.0 111.908 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -2.97 14.33 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 170.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -158.41 165.36 34.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.606 1.562 . . . . 0.0 112.571 -178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -148.71 30.22 0.82 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.629 1.171 . . . . 0.0 113.025 -174.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.4 t -164.1 150.38 11.22 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.285 1.834 . . . . 0.0 110.562 -176.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.2 p -93.81 -3.83 51.3 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.259 1.424 . . . . 0.0 113.429 172.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 132.08 -176.27 19.38 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.713 1.625 . . . . 0.0 113.579 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 59.15 -118.25 0.93 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.702 1.601 . . . . 0.0 111.595 -174.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -83.63 126.31 32.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.516 1.126 . . . . 0.0 111.009 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.41 ' CE1' HG23 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt -68.26 132.37 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.16 -172.48 31.69 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.69 1.614 . . . . 0.0 112.522 174.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -141.94 135.75 29.71 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.451 1.501 . . . . 0.0 109.993 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -153.45 141.13 8.07 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.532 1.063 . . . . 0.0 112.814 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -169.75 135.31 1.46 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.913 2.085 . . . . 0.0 109.396 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -113.77 140.2 48.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.209 1.003 . . . . 0.0 111.522 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.61 -2.36 8.85 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.981 1.312 . . . . 0.0 114.076 171.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.41 HG23 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.531 0 N-CA-C 111.426 -0.669 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -84.35 -4.43 58.88 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -174.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -157.03 151.52 25.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.614 1.566 . . . . 0.0 111.417 -176.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 t -164.82 -179.62 5.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.631 1.972 . . . . 0.0 110.706 -175.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.0 t -153.56 133.41 13.14 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.432 1.493 . . . . 0.0 110.891 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.19 -123.24 5.96 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.186 0.898 . . . . 0.0 111.079 -170.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -161.92 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.059 1.344 . . . . 0.0 112.086 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -85.78 137.97 32.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.88 1.272 . . . . 0.0 109.637 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt -68.56 131.41 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.01 47.69 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.445 1.497 . . . . 0.0 113.063 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -157.71 140.16 14.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.191 1.396 . . . . 0.0 111.114 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -139.42 30.76 2.39 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.267 1.413 . . . . 0.0 113.243 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.62 126.13 26.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.299 1.039 . . . . 0.0 112.021 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -102.82 139.87 37.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.355 1.062 . . . . 0.0 112.534 -172.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.44 1.13 2.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.831 1.652 . . . . 0.0 114.302 169.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.939 -0.464 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -156.6 140.38 16.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.408 1.483 . . . . 0.0 111.543 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.58 142.39 12.46 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.56 1.544 . . . . 0.0 111.202 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.7 m -142.93 136.99 29.13 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.73 1.612 . . . . 0.0 109.605 -174.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.4 p -160.94 131.82 5.38 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.753 1.221 . . . . 0.0 111.434 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.45 -9.76 57.52 Favored Glycine 0 N--CA 1.475 1.242 0 C-N-CA 124.55 1.072 . . . . 0.0 114.605 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.86 168.09 10.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.286 1.835 . . . . 0.0 113.04 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt -98.27 131.51 44.54 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.552 1.541 . . . . 0.0 111.299 -169.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt -64.53 133.33 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.99 179.3 47.18 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 126.294 1.902 . . . . 0.0 112.204 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.04 157.23 25.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.441 1.496 . . . . 0.0 111.502 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -161.78 154.83 25.91 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.365 0.983 . . . . 0.0 113.298 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -167.65 144.12 4.19 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.961 2.104 . . . . 0.0 109.641 -177.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -132.88 144.8 50.42 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.562 1.145 . . . . 0.0 111.548 -177.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.21 -1.6 4.68 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.203 1.401 . . . . 0.0 114.411 171.014 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -80.43 -16.63 53.95 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -155.52 157.56 37.08 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.471 1.509 . . . . 0.0 111.667 -176.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.2 m -144.71 139.89 28.22 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.429 1.892 . . . . 0.0 108.971 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.9 m -84.24 18.72 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.753 1.221 . . . . 0.0 114.13 -170.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.56 0.39 79.26 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.473 1.511 . . . . 0.0 113.669 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.3 -174.86 5.26 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.375 1.87 . . . . 0.0 112.192 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt -117.7 130.05 56.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.115 1.366 . . . . 0.0 110.964 -171.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt -62.94 134.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.48 -172.11 40.85 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.973 1.749 . . . . 0.0 112.421 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -159.97 156.2 26.73 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.704 1.601 . . . . 0.0 111.432 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.0 159.19 32.5 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 124.204 0.906 . . . . 0.0 113.488 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -168.45 152.32 5.81 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.187 2.195 . . . . 0.0 109.679 -176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -133.64 139.62 46.59 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.55 1.14 . . . . 0.0 111.756 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt -67.16 -16.98 64.64 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.987 1.315 . . . . 0.0 112.939 171.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -138.91 159.19 42.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.98 1.712 . . . . 0.0 111.624 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.35 159.94 41.23 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.929 1.691 . . . . 0.0 111.504 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 61.4 m -139.0 139.17 37.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.714 1.606 . . . . 0.0 109.795 -173.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 m -78.02 61.27 2.55 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.344 1.457 . . . . 0.0 112.61 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.17 64.89 3.08 Favored Glycine 0 N--CA 1.471 0.998 0 C-N-CA 125.718 1.627 . . . . 0.0 112.945 -177.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t0 73.72 -71.59 0.13 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 128.605 2.762 . . . . 0.0 112.345 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -113.97 125.71 54.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.46 1.504 . . . . 0.0 111.001 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt -63.72 133.1 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -149.95 -163.45 11.13 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.425 1.964 . . . . 0.0 112.442 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -158.8 -41.6 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.607 1.163 . . . . 0.0 112.576 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 86.4 153.14 22.37 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.81 1.195 . . . . 0.0 114.277 173.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -163.91 152.44 13.4 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.879 1.672 . . . . 0.0 111.39 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -178.1 -23.02 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.17 2.188 . . . . 0.0 114.774 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp 58.58 10.43 1.4 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.934 2.494 . . . . 0.0 113.652 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -156.94 136.84 12.53 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.356 1.462 . . . . 0.0 111.413 -177.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -162.1 148.06 13.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.442 1.497 . . . . 0.0 111.539 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.7 p -80.93 58.99 3.59 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.005 1.722 . . . . 0.0 111.196 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 m -68.4 -4.22 13.92 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.83 -16.59 80.63 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.507 1.051 . . . . 0.0 113.897 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -144.57 173.38 11.86 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.759 1.623 . . . . 0.0 112.369 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -100.5 131.18 46.55 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.618 1.167 . . . . 0.0 112.049 -167.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.4 ' CE2' HG23 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.69 133.14 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.31 -172.12 29.34 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.82 1.676 . . . . 0.0 112.687 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -158.32 141.5 14.97 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.379 1.471 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.2 153.64 23.9 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.365 0.984 . . . . 0.0 113.599 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -169.0 137.5 2.03 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.925 2.09 . . . . 0.0 109.75 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -111.71 138.34 48.41 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.264 1.026 . . . . 0.0 111.766 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.43 -1.25 4.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.353 1.461 . . . . 0.0 114.45 171.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . 0.45 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.409 ' CE1' HG21 ' A' ' 159' ' ' ILE . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.431 HG22 HG12 ' A' ' 53' ' ' VAL . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.431 HG12 HG22 ' A' ' 44' ' ' THR . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 64' ' ' LYS . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB2' ' H ' ' A' ' 61' ' ' THR . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.447 ' HB3' HG11 ' A' ' 128' ' ' VAL . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.447 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.409 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 121.042 0.448 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.402 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.402 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.433 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.412 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.466 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.797 0.808 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 HG12 ' A' ' 53' ' ' VAL . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.433 HG12 HG22 ' A' ' 44' ' ' THR . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.438 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.459 ' HB3' HG11 ' A' ' 128' ' ' VAL . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.459 HG11 ' HB3' ' A' ' 105' ' ' LEU . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 120.796 0.331 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.429 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.43 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.411 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.411 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.416 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 CA--C 1.543 0.678 0 CA-C-O 121.269 0.557 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.45 ' HB3' HG11 ' A' ' 128' ' ' VAL . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.45 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.126 0.489 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.446 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.446 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.463 ' HB3' HG11 ' A' ' 128' ' ' VAL . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.54 0.558 0 CA-C-O 121.095 0.474 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.408 ' HA ' ' HD2' ' A' ' 33' ' ' PRO . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 32' ' ' ASN . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.438 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.417 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.024 0.44 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE1' HG21 ' A' ' 159' ' ' ILE . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.408 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.408 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.402 ' HB3' HG11 ' A' ' 128' ' ' VAL . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 120.804 0.335 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.415 ' HB3' HG11 ' A' ' 128' ' ' VAL . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.415 HG11 ' HB3' ' A' ' 105' ' ' LEU . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.481 0.658 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.409 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.468 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.628 ' HB2' HD21 ' A' ' 131' ' ' LEU . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 106' ' ' ASN . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.437 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' TRP . . . . . 0.437 ' CZ2' ' HE3' ' A' ' 145' ' ' LYS . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.543 0.693 0 CA-C-O 121.14 0.495 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.406 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.407 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.407 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.401 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.427 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.406 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 121.155 0.502 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.422 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.413 HG22 HG12 ' A' ' 53' ' ' VAL . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 HG22 ' A' ' 44' ' ' THR . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.426 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.405 HG21 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.42 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.42 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 128' ' ' VAL . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.454 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.401 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.401 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt . . . . . 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.412 ' HE2' HD13 ' A' ' 122' ' ' ILE . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.412 HD13 ' HE2' ' A' ' 117' ' ' LYS . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.427 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.456 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.445 ' HB3' HG11 ' A' ' 128' ' ' VAL . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HE2' HD13 ' A' ' 122' ' ' ILE . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.406 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 159' ' ' ILE . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 158' ' ' VAL . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.29 0.566 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.411 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.411 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 121.602 0.715 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.404 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.404 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.405 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.099 0.476 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.406 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.406 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.464 ' HB3' HG11 ' A' ' 128' ' ' VAL . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LYS . . . . . 0.489 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.616 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.3 ttpp -152.59 33.52 0.5 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.819 1.247 . . . . 0.0 112.908 -175.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -156.69 143.91 18.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.411 1.484 . . . . 0.0 111.547 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.1 m -141.48 143.89 34.08 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.323 1.849 . . . . 0.0 109.279 -175.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -155.5 163.32 40.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.854 1.262 . . . . 0.0 111.214 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.45 -122.85 6.5 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.81 1.195 . . . . 0.0 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -159.41 -45.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.664 1.185 . . . . 0.0 112.21 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -84.14 136.39 34.0 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.535 1.134 . . . . 0.0 109.49 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.409 ' CE1' HG21 ' A' ' 159' ' ' ILE . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.431 HG22 HG12 ' A' ' 53' ' ' VAL . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.431 HG12 HG22 ' A' ' 44' ' ' THR . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 64' ' ' LYS . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB2' ' H ' ' A' ' 61' ' ' THR . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt -64.94 134.34 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -174.47 -167.93 34.57 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 126.258 1.885 . . . . 0.0 111.991 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -158.57 152.41 23.54 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.21 1.404 . . . . 0.0 111.663 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.59 151.9 19.85 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.415 1.007 . . . . 0.0 113.249 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -168.59 134.75 1.83 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.717 2.007 . . . . 0.0 109.506 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -108.26 138.97 43.63 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.023 0.929 . . . . 0.0 111.494 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -1.38 6.04 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.039 1.336 . . . . 0.0 114.242 170.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.447 ' HB3' HG11 ' A' ' 128' ' ' VAL . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.447 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.409 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.736 -0.545 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -69.33 138.78 54.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.194 0.998 . . . . 0.0 112.075 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -71.87 -38.3 70.05 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -173.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.5 t -171.04 173.13 5.17 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.759 2.024 . . . . 0.0 110.623 -176.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 m -143.5 -63.08 0.4 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.528 1.531 . . . . 0.0 111.261 176.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 -84.27 0.77 Allowed Glycine 0 CA--C 1.528 0.897 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 -174.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -165.07 -51.81 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.479 1.511 . . . . 0.0 111.888 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt -93.37 127.42 38.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.784 1.234 . . . . 0.0 109.996 175.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.402 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.402 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.433 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.412 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.94 130.53 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.08 -168.12 25.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.706 1.622 . . . . 0.0 112.494 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -156.6 139.57 15.35 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.321 1.448 . . . . 0.0 110.71 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -159.42 145.14 10.98 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.525 1.06 . . . . 0.0 113.07 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -168.66 134.96 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.893 2.077 . . . . 0.0 109.378 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -111.31 139.73 46.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.171 0.988 . . . . 0.0 111.621 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.08 -0.11 5.39 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.092 1.357 . . . . 0.0 114.137 170.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.466 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.127 -0.389 . . . . 0.0 112.127 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -141.05 155.75 46.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.716 1.607 . . . . 0.0 111.869 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -77.69 147.08 35.65 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.131 0.972 . . . . 0.0 111.496 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.7 m -141.38 124.93 16.73 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.621 1.568 . . . . 0.0 109.116 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 m -68.17 -9.98 50.85 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -169.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.91 -15.32 79.36 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.088 . . . . 0.0 113.855 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -147.67 -167.39 2.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.91 1.684 . . . . 0.0 111.911 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt -124.39 128.49 49.14 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.34 1.056 . . . . 0.0 112.476 -168.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 HG12 ' A' ' 53' ' ' VAL . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.433 HG12 HG22 ' A' ' 44' ' ' THR . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.438 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -62.72 133.23 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.63 151.17 22.95 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.485 1.993 . . . . 0.0 111.319 170.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -72.73 -40.12 66.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.583 0.691 . . . . 0.0 112.83 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.2 94.83 0.08 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.29 1.9 . . . . 0.0 114.326 170.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -167.09 158.28 12.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.832 1.653 . . . . 0.0 111.655 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -143.88 142.31 30.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.547 1.139 . . . . 0.0 110.623 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -6.4 25.49 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 171.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.459 ' HB3' HG11 ' A' ' 128' ' ' VAL . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.459 HG11 ' HB3' ' A' ' 105' ' ' LEU . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -71.97 -27.25 62.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -176.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.3 t30 71.58 136.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.288 2.635 . . . . 0.0 113.251 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.4 t -168.87 172.76 7.51 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.162 2.185 . . . . 0.0 110.293 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -142.86 6.49 1.6 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.914 1.686 . . . . 0.0 113.758 -176.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -83.96 -8.76 83.65 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.591 1.091 . . . . 0.0 114.771 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -102.05 160.17 14.73 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.669 1.588 . . . . 0.0 112.74 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.79 133.34 34.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 0.0 110.762 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.429 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt -67.22 133.44 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -166.9 -165.77 24.86 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 125.726 1.632 . . . . 0.0 112.61 176.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -156.37 140.15 16.12 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.559 1.544 . . . . 0.0 110.535 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -152.71 145.64 13.39 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.453 1.025 . . . . 0.0 113.302 -177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -169.32 150.98 4.41 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.228 2.211 . . . . 0.0 109.588 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -136.07 140.05 43.49 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.468 1.107 . . . . 0.0 111.496 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.71 -3.81 10.35 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.716 1.207 . . . . 0.0 114.088 170.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.43 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.411 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.416 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? 74.01 121.56 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 128.022 2.529 . . . . 0.0 112.336 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -151.96 139.16 19.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.201 1.4 . . . . 0.0 111.104 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.5 m -150.55 131.74 14.48 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.994 1.718 . . . . 0.0 109.037 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.5 m -161.71 117.5 2.06 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 0.0 110.694 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -102.16 0.3 50.97 Favored Glycine 0 N--CA 1.478 1.436 0 C-N-CA 125.076 1.322 . . . . 0.0 113.853 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -102.6 169.3 8.73 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.119 2.167 . . . . 0.0 113.162 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt -95.1 130.38 41.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.298 1.439 . . . . 0.0 111.262 -169.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.18 134.5 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.51 153.66 24.99 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.451 1.977 . . . . 0.0 111.634 170.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -73.19 -36.17 66.5 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -176.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.72 168.54 34.39 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 125.525 1.536 . . . . 0.0 115.484 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.0 t0 72.26 161.26 0.24 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 128.372 2.669 . . . . 0.0 113.406 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -129.75 155.53 45.77 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.864 1.666 . . . . 0.0 112.006 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -2.2 13.57 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.644 1.177 . . . . 0.0 114.129 170.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.45 ' HB3' HG11 ' A' ' 128' ' ' VAL . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.45 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -90.69 -20.52 22.38 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.114 0.965 . . . . 0.0 113.578 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -113.08 6.37 17.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.236 1.814 . . . . 0.0 113.914 -177.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -94.09 19.18 9.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.619 1.967 . . . . 0.0 113.429 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.8 p -67.22 -14.18 62.66 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.5 -2.03 68.14 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.31 1.433 . . . . 0.0 114.181 170.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -112.17 161.55 16.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.924 1.69 . . . . 0.0 111.792 -176.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -90.98 139.87 30.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.587 1.155 . . . . 0.0 110.7 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.446 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.446 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.43 132.46 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -148.84 -143.79 3.84 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.854 1.693 . . . . 0.0 112.079 173.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -149.66 136.42 19.42 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.665 1.586 . . . . 0.0 110.635 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -110.29 -168.33 19.59 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.621 1.105 . . . . 0.0 115.192 -169.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.1 t0 70.85 171.12 0.32 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.911 2.484 . . . . 0.0 112.487 -173.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -145.72 146.91 31.43 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.616 1.167 . . . . 0.0 111.754 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.15 -22.52 66.92 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.395 1.078 . . . . 0.0 112.223 171.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.463 ' HB3' HG11 ' A' ' 128' ' ' VAL . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.675 -0.57 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -139.51 155.91 47.25 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.902 1.681 . . . . 0.0 111.648 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -145.86 165.46 28.83 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.805 1.642 . . . . 0.0 111.655 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -155.6 164.44 38.64 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.023 1.729 . . . . 0.0 110.686 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.5 p -168.37 -179.61 4.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.846 1.658 . . . . 0.0 112.064 -169.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.78 -53.84 4.89 Favored Glycine 0 N--CA 1.471 1.009 0 C-N-CA 125.195 1.379 . . . . 0.0 112.661 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.08 175.93 6.68 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.343 1.457 . . . . 0.0 111.683 173.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -116.8 127.95 54.82 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.804 1.642 . . . . 0.0 110.735 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.408 ' HA ' ' HD2' ' A' ' 33' ' ' PRO . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 32' ' ' ASN . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.438 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -67.47 132.65 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.33 -169.74 18.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.966 1.746 . . . . 0.0 112.324 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -156.81 139.57 15.14 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.107 1.363 . . . . 0.0 111.008 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.82 154.62 13.67 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 124.475 1.036 . . . . 0.0 113.509 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.91 130.31 1.2 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.963 2.105 . . . . 0.0 109.413 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -96.56 132.22 42.38 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.441 0.696 . . . . 0.0 111.747 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.26 -0.38 4.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.585 1.554 . . . . 0.0 114.3 170.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.417 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -157.18 151.3 24.82 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.327 1.451 . . . . 0.0 111.682 -177.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -145.63 160.93 40.96 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.178 1.791 . . . . 0.0 110.564 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.9 t -165.36 163.83 19.82 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.74 1.616 . . . . 0.0 111.359 -175.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -102.8 -7.54 21.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.451 1.5 . . . . 0.0 112.646 169.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -69.31 -21.96 76.07 Favored Glycine 0 N--CA 1.474 1.194 0 C-N-CA 124.643 1.116 . . . . 0.0 113.659 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -158.03 163.25 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.535 2.334 . . . . 0.0 110.116 169.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt -104.79 132.17 51.35 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.306 1.443 . . . . 0.0 111.395 -168.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE1' HG21 ' A' ' 159' ' ' ILE . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.408 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.408 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt -66.43 133.76 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -171.77 -172.14 37.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.266 1.889 . . . . 0.0 111.995 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -158.42 152.22 23.59 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.184 1.394 . . . . 0.0 111.578 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.75 152.65 22.1 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.381 0.991 . . . . 0.0 113.113 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -166.36 132.05 2.36 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.587 1.955 . . . . 0.0 109.405 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -109.36 140.21 43.35 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.247 1.019 . . . . 0.0 111.559 -176.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.26 -16.78 64.3 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.048 1.339 . . . . 0.0 112.992 172.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.402 ' HB3' HG11 ' A' ' 128' ' ' VAL . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.181 -0.367 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -147.59 8.78 0.9 Allowed 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.78 162.93 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.835 1.654 . . . . 0.0 112.197 -174.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 97.8 m -79.52 143.44 34.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.48 1.112 . . . . 0.0 109.243 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.3 p -160.51 155.39 24.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.451 1.5 . . . . 0.0 110.693 175.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 77.31 -43.81 2.09 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 125.047 1.308 . . . . 0.0 113.406 -176.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -95.02 161.36 14.17 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.389 1.876 . . . . 0.0 111.804 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -90.08 135.22 33.79 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.277 1.431 . . . . 0.0 110.836 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt -64.12 133.75 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.56 -175.8 43.28 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.001 1.762 . . . . 0.0 112.374 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -160.43 156.38 25.97 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.575 1.55 . . . . 0.0 111.295 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.28 156.18 27.85 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.245 0.926 . . . . 0.0 113.412 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -167.99 149.0 5.14 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.203 2.201 . . . . 0.0 109.706 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -135.22 142.05 45.94 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.573 1.149 . . . . 0.0 111.625 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -2.76 8.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.712 1.205 . . . . 0.0 114.032 169.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.415 ' HB3' HG11 ' A' ' 128' ' ' VAL . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.415 HG11 ' HB3' ' A' ' 105' ' ' LEU . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.863 -0.495 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -156.13 142.48 18.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.281 1.432 . . . . 0.0 111.588 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 12.6 p-10 -163.99 148.89 10.38 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.987 1.715 . . . . 0.0 111.318 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 m -68.09 -34.12 75.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.073 1.349 . . . . 0.0 112.855 -174.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -161.55 151.72 17.26 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.053 1.341 . . . . 0.0 111.197 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 66.08 -113.65 5.91 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.119 0.866 . . . . 0.0 112.527 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -156.24 -43.71 0.08 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.779 1.231 . . . . 0.0 112.343 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt -88.37 128.22 35.5 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.767 1.227 . . . . 0.0 110.867 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.409 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.18 133.31 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -167.3 172.42 42.28 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.184 1.849 . . . . 0.0 112.814 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -163.76 143.8 8.42 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.016 1.726 . . . . 0.0 110.737 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 176.64 170.52 39.29 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.796 0.712 . . . . 0.0 114.704 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -153.0 2.33 0.3 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.231 1.812 . . . . 0.0 113.122 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 60.63 165.9 0.08 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 127.693 2.397 . . . . 0.0 113.836 -169.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.13 0.14 56.39 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.419 1.087 . . . . 0.0 112.304 168.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.805 -0.518 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -85.53 -11.51 53.96 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -65.9 132.74 49.35 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.557 1.143 . . . . 0.0 112.468 179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.4 p -86.72 -35.72 19.08 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.608 1.563 . . . . 0.0 112.762 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.5 t -164.09 143.39 7.73 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.866 1.667 . . . . 0.0 111.275 174.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -103.78 4.93 46.61 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.177 1.37 . . . . 0.0 113.917 175.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.438 ' HA ' ' HE1' ' A' ' 150' ' ' TRP . 74.1 m-20 -117.51 154.97 30.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.994 1.397 . . . . 0.0 112.611 -172.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.24 146.61 32.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.096 1.359 . . . . 0.0 113.048 -167.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.56 132.59 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.54 -169.49 32.03 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.731 1.634 . . . . 0.0 112.788 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -157.82 140.79 15.03 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.4 1.48 . . . . 0.0 110.857 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.61 151.69 21.29 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.476 1.036 . . . . 0.0 113.391 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -168.33 136.65 2.25 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.758 2.023 . . . . 0.0 109.757 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -106.98 138.94 42.19 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.189 0.996 . . . . 0.0 111.774 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.46 20.8 0.07 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.441 1.896 . . . . 0.0 114.358 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.468 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.628 ' HB2' HD21 ' A' ' 131' ' ' LEU . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 106' ' ' ASN . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.437 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' TRP . . . . . 0.438 ' HE1' ' HA ' ' A' ' 7' ' ' ASP . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp 62.66 28.9 16.79 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 125.73 1.612 . . . . 0.0 113.605 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -79.21 -5.61 54.68 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.153 1.381 . . . . 0.0 114.3 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -70.08 160.7 31.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.953 . . . . 0.0 112.241 178.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 t -157.1 158.43 36.39 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.068 1.347 . . . . 0.0 110.964 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.93 -121.21 5.45 Favored Glycine 0 N--CA 1.468 0.806 0 C-N-CA 124.334 0.969 . . . . 0.0 111.008 -171.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -158.8 -42.49 0.06 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.267 1.027 . . . . 0.0 112.822 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -89.26 129.91 35.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.524 1.13 . . . . 0.0 110.383 173.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.406 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.407 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.407 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.401 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt -63.95 134.3 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.95 -176.8 48.21 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.229 1.871 . . . . 0.0 112.428 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -161.06 155.6 23.36 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.83 1.652 . . . . 0.0 110.979 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -169.6 162.35 35.85 Favored Glycine 0 CA--C 1.528 0.844 0 CA-C-O 121.82 0.678 . . . . 0.0 114.141 -178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -166.39 170.7 12.74 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.167 2.587 . . . . 0.0 110.174 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -140.67 143.86 35.36 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.18 0.992 . . . . 0.0 111.368 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.72 -3.54 9.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.748 1.219 . . . . 0.0 114.035 169.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.427 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.406 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -68.47 -10.2 53.88 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -56.82 -17.69 10.2 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.571 1.548 . . . . 0.0 114.556 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.1 p -59.04 -21.19 58.71 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.293 1.437 . . . . 0.0 113.902 170.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.6 m -87.2 -9.82 54.16 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -112.35 -21.48 6.19 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 125.73 1.633 . . . . 0.0 114.376 177.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -96.27 160.39 14.45 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 176.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -88.81 146.33 25.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.32 1.448 . . . . 0.0 110.597 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.422 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.413 HG22 HG12 ' A' ' 53' ' ' VAL . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 HG22 ' A' ' 44' ' ' THR . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.426 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -61.34 132.94 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.27 171.24 42.16 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 126.402 1.954 . . . . 0.0 112.306 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -164.1 158.73 19.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.916 1.687 . . . . 0.0 111.253 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.14 167.04 38.04 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 121.854 0.697 . . . . 0.0 114.341 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -166.11 118.39 1.06 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.359 2.264 . . . . 0.0 108.499 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -77.88 142.9 38.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.39 0.676 . . . . 0.0 111.812 -171.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp -65.62 -7.87 17.32 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.876 1.27 . . . . 0.0 113.724 170.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.405 HG21 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.877 -0.489 . . . . 0.0 111.877 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt 61.82 17.02 8.45 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 126.366 1.867 . . . . 0.0 115.065 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -145.6 141.09 27.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.127 1.771 . . . . 0.0 110.826 -172.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -161.73 43.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 125.498 1.519 . . . . 0.0 111.632 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 t -153.61 162.19 41.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.664 1.185 . . . . 0.0 111.706 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.01 -156.33 26.77 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.008 1.766 . . . . 0.0 112.239 -172.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -160.25 -45.36 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.35 1.06 . . . . 0.0 112.294 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt -82.7 143.29 31.02 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.44 1.096 . . . . 0.0 108.972 168.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.42 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.42 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt -66.34 134.11 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.31 151.06 22.98 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 126.415 1.959 . . . . 0.0 111.583 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -75.44 -35.78 60.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -175.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.21 171.9 39.05 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.667 1.603 . . . . 0.0 115.782 170.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 t0 73.19 159.81 0.22 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.705 2.802 . . . . 0.0 113.227 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -127.68 156.27 42.62 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.877 1.671 . . . . 0.0 111.908 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -2.97 14.33 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 170.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 128' ' ' VAL . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.454 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -158.41 165.36 34.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.606 1.562 . . . . 0.0 112.571 -178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -148.71 30.22 0.82 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.629 1.171 . . . . 0.0 113.025 -174.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.4 t -164.1 150.38 11.22 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.285 1.834 . . . . 0.0 110.562 -176.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.2 p -93.81 -3.83 51.3 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.259 1.424 . . . . 0.0 113.429 172.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 132.08 -176.27 19.38 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.713 1.625 . . . . 0.0 113.579 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 59.15 -118.25 0.93 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.702 1.601 . . . . 0.0 111.595 -174.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -83.63 126.31 32.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.516 1.126 . . . . 0.0 111.009 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.401 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.401 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt -68.26 132.37 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.16 -172.48 31.69 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.69 1.614 . . . . 0.0 112.522 174.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -141.94 135.75 29.71 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.451 1.501 . . . . 0.0 109.993 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -153.45 141.13 8.07 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.532 1.063 . . . . 0.0 112.814 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -169.75 135.31 1.46 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.913 2.085 . . . . 0.0 109.396 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -113.77 140.2 48.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.209 1.003 . . . . 0.0 111.522 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.61 -2.36 8.85 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.981 1.312 . . . . 0.0 114.076 171.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.412 ' HE2' HD13 ' A' ' 122' ' ' ILE . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.412 HD13 ' HE2' ' A' ' 117' ' ' LYS . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.427 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.531 0 N-CA-C 111.426 -0.669 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -84.35 -4.43 58.88 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -174.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -157.03 151.52 25.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.614 1.566 . . . . 0.0 111.417 -176.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 t -164.82 -179.62 5.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.631 1.972 . . . . 0.0 110.706 -175.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.0 t -153.56 133.41 13.14 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.432 1.493 . . . . 0.0 110.891 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.19 -123.24 5.96 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.186 0.898 . . . . 0.0 111.079 -170.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -161.92 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.059 1.344 . . . . 0.0 112.086 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -85.78 137.97 32.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.88 1.272 . . . . 0.0 109.637 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.456 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt -68.56 131.41 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.01 47.69 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.445 1.497 . . . . 0.0 113.063 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -157.71 140.16 14.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.191 1.396 . . . . 0.0 111.114 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -139.42 30.76 2.39 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.267 1.413 . . . . 0.0 113.243 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.62 126.13 26.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.299 1.039 . . . . 0.0 112.021 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -102.82 139.87 37.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.355 1.062 . . . . 0.0 112.534 -172.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.44 1.13 2.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.831 1.652 . . . . 0.0 114.302 169.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.939 -0.464 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -156.6 140.38 16.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.408 1.483 . . . . 0.0 111.543 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.58 142.39 12.46 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.56 1.544 . . . . 0.0 111.202 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.7 m -142.93 136.99 29.13 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.73 1.612 . . . . 0.0 109.605 -174.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.4 p -160.94 131.82 5.38 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.753 1.221 . . . . 0.0 111.434 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.45 -9.76 57.52 Favored Glycine 0 N--CA 1.475 1.242 0 C-N-CA 124.55 1.072 . . . . 0.0 114.605 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.86 168.09 10.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.286 1.835 . . . . 0.0 113.04 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt -98.27 131.51 44.54 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.552 1.541 . . . . 0.0 111.299 -169.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt -64.53 133.33 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.99 179.3 47.18 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 126.294 1.902 . . . . 0.0 112.204 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.04 157.23 25.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.441 1.496 . . . . 0.0 111.502 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -161.78 154.83 25.91 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.365 0.983 . . . . 0.0 113.298 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -167.65 144.12 4.19 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.961 2.104 . . . . 0.0 109.641 -177.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -132.88 144.8 50.42 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.562 1.145 . . . . 0.0 111.548 -177.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.21 -1.6 4.68 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.203 1.401 . . . . 0.0 114.411 171.014 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.445 ' HB3' HG11 ' A' ' 128' ' ' VAL . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HE2' HD13 ' A' ' 122' ' ' ILE . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.406 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 159' ' ' ILE . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 158' ' ' VAL . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -80.43 -16.63 53.95 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -155.52 157.56 37.08 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.471 1.509 . . . . 0.0 111.667 -176.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.2 m -144.71 139.89 28.22 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.429 1.892 . . . . 0.0 108.971 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.9 m -84.24 18.72 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.753 1.221 . . . . 0.0 114.13 -170.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.56 0.39 79.26 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.473 1.511 . . . . 0.0 113.669 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.3 -174.86 5.26 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.375 1.87 . . . . 0.0 112.192 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt -117.7 130.05 56.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.115 1.366 . . . . 0.0 110.964 -171.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.411 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.411 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt -62.94 134.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.48 -172.11 40.85 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.973 1.749 . . . . 0.0 112.421 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -159.97 156.2 26.73 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.704 1.601 . . . . 0.0 111.432 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.0 159.19 32.5 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 124.204 0.906 . . . . 0.0 113.488 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -168.45 152.32 5.81 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.187 2.195 . . . . 0.0 109.679 -176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -133.64 139.62 46.59 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.55 1.14 . . . . 0.0 111.756 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt -67.16 -16.98 64.64 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.987 1.315 . . . . 0.0 112.939 171.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -138.91 159.19 42.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.98 1.712 . . . . 0.0 111.624 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.35 159.94 41.23 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.929 1.691 . . . . 0.0 111.504 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 61.4 m -139.0 139.17 37.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.714 1.606 . . . . 0.0 109.795 -173.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 m -78.02 61.27 2.55 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.344 1.457 . . . . 0.0 112.61 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.17 64.89 3.08 Favored Glycine 0 N--CA 1.471 0.998 0 C-N-CA 125.718 1.627 . . . . 0.0 112.945 -177.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t0 73.72 -71.59 0.13 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 128.605 2.762 . . . . 0.0 112.345 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -113.97 125.71 54.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.46 1.504 . . . . 0.0 111.001 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.404 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.404 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.405 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt -63.72 133.1 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -149.95 -163.45 11.13 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.425 1.964 . . . . 0.0 112.442 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -158.8 -41.6 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.607 1.163 . . . . 0.0 112.576 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 86.4 153.14 22.37 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.81 1.195 . . . . 0.0 114.277 173.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -163.91 152.44 13.4 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.879 1.672 . . . . 0.0 111.39 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -178.1 -23.02 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.17 2.188 . . . . 0.0 114.774 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp 58.58 10.43 1.4 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.934 2.494 . . . . 0.0 113.652 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -156.94 136.84 12.53 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.356 1.462 . . . . 0.0 111.413 -177.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -162.1 148.06 13.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.442 1.497 . . . . 0.0 111.539 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.7 p -80.93 58.99 3.59 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.005 1.722 . . . . 0.0 111.196 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 m -68.4 -4.22 13.92 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.83 -16.59 80.63 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.507 1.051 . . . . 0.0 113.897 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -144.57 173.38 11.86 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.759 1.623 . . . . 0.0 112.369 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -100.5 131.18 46.55 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.618 1.167 . . . . 0.0 112.049 -167.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.406 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.406 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.69 133.14 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.31 -172.12 29.34 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.82 1.676 . . . . 0.0 112.687 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -158.32 141.5 14.97 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.379 1.471 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.2 153.64 23.9 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.365 0.984 . . . . 0.0 113.599 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -169.0 137.5 2.03 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.925 2.09 . . . . 0.0 109.75 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -111.71 138.34 48.41 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.264 1.026 . . . . 0.0 111.766 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.43 -1.25 4.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.353 1.461 . . . . 0.0 114.45 171.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.464 ' HB3' HG11 ' A' ' 128' ' ' VAL . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LYS . . . . . 0.489 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.409 ' CE1' HG21 ' A' ' 159' ' ' ILE . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.431 HG22 HG12 ' A' ' 53' ' ' VAL . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.431 HG12 HG22 ' A' ' 44' ' ' THR . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 64' ' ' LYS . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB2' ' H ' ' A' ' 61' ' ' THR . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.447 ' HB3' HG11 ' A' ' 128' ' ' VAL . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.447 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.409 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 121.042 0.448 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.402 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.402 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.433 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.412 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.466 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.797 0.808 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 HG12 ' A' ' 53' ' ' VAL . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.433 HG12 HG22 ' A' ' 44' ' ' THR . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.438 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.459 ' HB3' HG11 ' A' ' 128' ' ' VAL . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.459 HG11 ' HB3' ' A' ' 105' ' ' LEU . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 120.796 0.331 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.429 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.43 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.411 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.411 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.416 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 CA--C 1.543 0.678 0 CA-C-O 121.269 0.557 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.45 ' HB3' HG11 ' A' ' 128' ' ' VAL . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.45 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.126 0.489 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.446 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.446 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.463 ' HB3' HG11 ' A' ' 128' ' ' VAL . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.54 0.558 0 CA-C-O 121.095 0.474 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.408 ' HA ' ' HD2' ' A' ' 33' ' ' PRO . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 32' ' ' ASN . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.438 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.417 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.024 0.44 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE1' HG21 ' A' ' 159' ' ' ILE . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.408 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.408 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.402 ' HB3' HG11 ' A' ' 128' ' ' VAL . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 120.804 0.335 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.415 ' HB3' HG11 ' A' ' 128' ' ' VAL . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.415 HG11 ' HB3' ' A' ' 105' ' ' LEU . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.481 0.658 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.409 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.468 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.628 ' HB2' HD21 ' A' ' 131' ' ' LEU . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 106' ' ' ASN . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.437 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . 0.437 ' CZ2' ' HE3' ' A' ' 145' ' ' LYS . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.543 0.693 0 CA-C-O 121.14 0.495 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.406 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.407 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.407 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.401 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.427 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.406 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 121.155 0.502 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.422 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.413 HG22 HG12 ' A' ' 53' ' ' VAL . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 HG22 ' A' ' 44' ' ' THR . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.426 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.405 HG21 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.42 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.42 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 128' ' ' VAL . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.454 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.401 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.401 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt . . . . . 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.412 ' HE2' HD13 ' A' ' 122' ' ' ILE . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.412 HD13 ' HE2' ' A' ' 117' ' ' LYS . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.427 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.456 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.445 ' HB3' HG11 ' A' ' 128' ' ' VAL . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HE2' HD13 ' A' ' 122' ' ' ILE . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.406 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 159' ' ' ILE . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 158' ' ' VAL . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.29 0.566 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.411 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.411 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 121.602 0.715 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.404 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.404 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.405 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.099 0.476 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.406 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.406 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.464 ' HB3' HG11 ' A' ' 128' ' ' VAL . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . 0.489 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.616 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.3 ttpp -152.59 33.52 0.5 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.819 1.247 . . . . 0.0 112.908 -175.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -156.69 143.91 18.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.411 1.484 . . . . 0.0 111.547 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.1 m -141.48 143.89 34.08 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.323 1.849 . . . . 0.0 109.279 -175.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.4 t -155.5 163.32 40.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.854 1.262 . . . . 0.0 111.214 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.45 -122.85 6.5 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.81 1.195 . . . . 0.0 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -159.41 -45.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.664 1.185 . . . . 0.0 112.21 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -84.14 136.39 34.0 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.535 1.134 . . . . 0.0 109.49 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.8 t -130.09 172.76 11.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.801 1.64 . . . . 0.0 112.078 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -53.46 -45.25 69.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.172 1.389 . . . . 0.0 113.427 -171.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -60.13 -52.27 66.06 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.881 0.872 . . . . 0.0 111.424 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -57.48 -49.82 75.03 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.837 0.855 . . . . 0.0 110.724 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.42 -47.05 79.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.361 0.982 . . . . 0.0 112.216 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.37 -43.9 92.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.897 1.279 . . . . 0.0 111.922 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -72.16 -39.17 68.91 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.028 -1.045 . . . . 0.0 112.586 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -57.41 -40.37 78.13 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.612 0.765 . . . . 0.0 110.601 172.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.3 -49.62 68.78 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.357 1.063 . . . . 0.0 111.683 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.05 -43.7 91.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.435 0.694 . . . . 0.0 112.06 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -65.44 -38.84 91.06 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.639 0.376 . . . . 0.0 111.88 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.62 93.76 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.015 -1.053 . . . . 0.0 112.982 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -42.59 98.31 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.524 0.602 . . . . 0.0 111.787 172.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -60.39 -48.65 80.81 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.962 0.905 . . . . 0.0 111.65 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -65.39 -42.78 92.3 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.243 -0.91 . . . . 0.0 112.726 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.409 ' CE1' HG21 ' A' ' 159' ' ' ILE . 56.7 t80 -62.84 -53.6 51.65 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.995 0.918 . . . . 0.0 111.736 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -63.56 -36.96 85.5 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -68.52 -33.54 74.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.096 0.862 . . . . 0.0 112.702 174.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.2 m -68.97 -45.97 69.29 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.329 -0.857 . . . . 0.0 110.717 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.64 -23.92 65.14 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.598 1.159 . . . . 0.0 113.282 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.3 m -80.98 -2.37 47.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.728 1.611 . . . . 0.0 113.875 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.47 -4.67 85.9 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.204 1.383 . . . . 0.0 115.234 173.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.8 t60 -165.09 139.05 4.85 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.594 1.558 . . . . 0.0 111.982 -173.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -87.99 104.1 6.2 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 124.644 1.178 . . . . 0.0 111.723 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -63.47 -8.94 16.19 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.239 3.293 . . . . 0.0 113.672 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -60.04 -23.31 63.62 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.714 1.205 . . . . 0.0 112.751 169.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -104.68 125.04 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.587 1.955 . . . . 0.0 109.355 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -102.29 -11.26 18.84 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.42 1.088 . . . . 0.0 113.715 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -107.25 14.15 26.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.033 1.733 . . . . 0.0 113.771 -175.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.52 138.62 51.16 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.083 0.953 . . . . 0.0 110.981 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 83.8 t -85.08 115.68 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 88.3 m -101.37 112.06 64.56 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.347 1.059 . . . . 0.0 110.435 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.04 -23.96 21.07 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.894 2.396 . . . . 0.0 113.169 -175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 67.34 1.52 2.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.324 1.85 . . . . 0.0 115.487 169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.41 163.15 44.41 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.033 1.302 . . . . 0.0 113.246 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.431 HG22 HG12 ' A' ' 53' ' ' VAL . 37.5 p -139.42 163.69 31.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.395 1.478 . . . . 0.0 111.793 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.07 -177.6 6.53 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.341 1.456 . . . . 0.0 111.265 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.06 132.23 53.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.546 1.138 . . . . 0.0 110.962 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -156.39 134.47 11.24 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.91 1.684 . . . . 0.0 110.626 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 54.92 31.0 14.98 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.679 1.191 . . . . 0.0 112.627 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.8 m120 68.53 16.97 9.1 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.857 2.063 . . . . 0.0 114.048 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.6 mt -114.19 153.43 29.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.189 1.796 . . . . 0.0 110.21 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -86.69 129.82 34.72 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -106.63 145.87 31.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.828 1.651 . . . . 0.0 112.193 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.431 HG12 HG22 ' A' ' 44' ' ' THR . 14.8 m -115.94 135.2 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.143 1.377 . . . . 0.0 109.744 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -72.94 142.96 47.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.91 . . . . 0.0 112.431 174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 43.6 mmm -81.78 152.53 26.92 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.59 0.756 . . . . 0.0 111.716 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.49 161.38 30.88 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.465 -0.772 . . . . 0.0 111.694 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 91.3 p -53.74 -23.35 11.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -166.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -82.94 -11.62 58.02 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 121.143 1.792 . . . . 0.0 113.491 174.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.82 17.9 11.85 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.691 2.396 . . . . 0.0 109.747 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.36 -15.82 68.49 Favored Glycine 0 N--CA 1.474 1.168 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -165.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 64' ' ' LYS . 44.4 p -137.09 162.46 33.31 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.653 1.981 . . . . 0.0 108.797 175.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -52.51 -45.19 66.14 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 119.337 -0.364 . . . . 0.0 110.803 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.5 -55.37 32.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.165 -0.921 . . . . 0.0 112.135 174.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB2' ' H ' ' A' ' 61' ' ' THR . 1.7 mptm? -45.93 -50.19 14.9 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.87 1.214 . . . . 0.0 113.84 173.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.41 -39.24 68.08 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.75 -41.56 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 118.635 0.652 . . . . 0.0 110.374 172.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.11 -37.19 84.18 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.924 1.29 . . . . 0.0 112.718 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -69.12 -34.12 74.55 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.171 0.988 . . . . 0.0 112.878 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -89.55 -26.28 20.94 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.569 1.148 . . . . 0.0 113.82 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.27 -45.41 42.36 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 127.703 2.401 . . . . 0.0 114.231 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -57.35 -25.6 66.38 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.992 3.128 . . . . 0.0 115.504 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.4 mm -110.55 -34.09 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.859 1.264 . . . . 0.0 112.844 -173.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -124.01 142.19 51.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.34 1.456 . . . . 0.0 110.694 -169.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.1 p -65.21 154.85 36.87 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.114 0.566 . . . . 0.0 109.773 173.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -52.84 -48.12 67.25 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.428 -0.795 . . . . 0.0 111.481 -179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -62.41 -35.95 80.83 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.532 1.133 . . . . 0.0 112.808 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.33 96.13 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.233 0.924 . . . . 0.0 112.177 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.11 -48.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.742 0.817 . . . . 0.0 110.534 176.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -60.13 -42.97 95.95 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.586 0.63 . . . . 0.0 111.763 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -61.3 -45.66 93.55 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.434 0.694 . . . . 0.0 112.101 175.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.39 -14.24 81.01 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 123.788 0.709 . . . . 0.0 113.97 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -76.84 -51.95 10.38 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.105 1.452 . . . . 0.0 109.058 167.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -62.79 -43.7 98.12 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -66.6 -23.51 66.2 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.399 1.08 . . . . 0.0 113.911 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -110.08 6.78 23.18 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.792 1.637 . . . . 0.0 112.821 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 68.28 27.45 6.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.569 1.948 . . . . 0.0 113.711 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -54.75 136.95 45.62 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.634 1.574 . . . . 0.0 110.504 174.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.45 178.29 8.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.186 0.994 . . . . 0.0 112.217 -171.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.1 t -127.29 134.11 66.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 125.793 1.637 . . . . 0.0 108.45 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -137.27 131.23 32.01 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.526 1.131 . . . . 0.0 109.066 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm 57.18 30.48 18.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.916 0.886 . . . . 0.0 112.424 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.65 73.72 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 126.744 2.116 . . . . 0.0 115.357 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -101.88 135.1 44.02 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.563 1.545 . . . . 0.0 111.733 -177.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -62.33 141.4 58.31 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 171.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.05 151.29 42.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.945 0.898 . . . . 0.0 112.763 173.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.3 m -129.36 148.75 70.51 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 125.79 1.636 . . . . 0.0 109.937 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.99 145.43 44.92 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.59 2.193 . . . . 0.0 111.104 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.6 mt -64.94 134.34 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 110.757 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -174.47 -167.93 34.57 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 126.258 1.885 . . . . 0.0 111.991 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -158.57 152.41 23.54 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.21 1.404 . . . . 0.0 111.663 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.59 151.9 19.85 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.415 1.007 . . . . 0.0 113.249 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -168.59 134.75 1.83 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.717 2.007 . . . . 0.0 109.506 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -108.26 138.97 43.63 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.023 0.929 . . . . 0.0 111.494 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -1.38 6.04 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.039 1.336 . . . . 0.0 114.242 170.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.447 ' HB3' HG11 ' A' ' 128' ' ' VAL . 53.0 mt -70.39 118.23 12.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.131 1.773 . . . . 0.0 110.714 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -92.45 79.62 4.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.732 1.213 . . . . 0.0 110.303 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -68.65 -26.79 65.5 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.56 0.744 . . . . 0.0 112.15 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -61.08 -17.95 55.26 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.104 1.362 . . . . 0.0 113.788 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.23 -0.46 14.6 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.956 1.702 . . . . 0.0 113.056 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.7 p -70.17 163.29 26.67 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.969 0.907 . . . . 0.0 113.277 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -135.89 142.36 44.69 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.034 1.333 . . . . 0.0 110.875 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 149.32 21.86 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.363 1.065 . . . . 0.0 113.833 -176.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -138.47 123.77 19.32 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 128.357 2.663 . . . . 0.0 109.129 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.98 132.68 47.06 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.091 0.86 . . . . 0.0 111.293 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.36 -39.77 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.479 1.512 . . . . 0.0 112.24 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.9 t -158.71 144.96 16.97 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.636 0.774 . . . . 0.0 110.755 -176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -147.39 96.92 2.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.779 1.232 . . . . 0.0 109.009 -175.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -136.72 90.54 2.56 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.939 1.296 . . . . 0.0 111.785 -168.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.28 -119.66 19.48 Favored Glycine 0 N--CA 1.47 0.91 0 C-N-CA 124.004 0.811 . . . . 0.0 111.535 176.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.7 m -81.1 6.65 13.05 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -130.69 135.19 47.58 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.058 1.743 . . . . 0.0 110.576 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.4 mt -141.01 140.02 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 125.379 1.471 . . . . 0.0 109.35 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.9 m -121.95 134.52 54.83 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.805 1.242 . . . . 0.0 111.479 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.33 148.18 44.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.775 1.63 . . . . 0.0 112.155 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -101.7 147.22 26.71 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.373 1.869 . . . . 0.0 107.944 168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -126.64 124.89 40.93 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 126.012 1.725 . . . . 0.0 109.895 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.4 m -93.5 113.03 25.06 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 169.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.447 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.0 t -114.41 105.58 53.63 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 123.703 0.801 . . . . 0.0 110.118 -171.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -65.38 161.16 39.17 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.312 2.675 . . . . 0.0 111.21 174.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -110.52 149.41 30.39 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.485 0.659 . . . . 0.0 112.321 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.8 mt -75.19 -10.23 59.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.922 1.289 . . . . 0.0 112.678 170.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -81.02 -22.0 39.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.695 1.598 . . . . 0.0 112.821 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.37 7.72 75.75 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.642 1.115 . . . . 0.0 113.603 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.2 m -74.29 157.7 86.25 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.429 1.092 . . . . 0.0 112.007 170.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.68 146.88 42.22 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 124.263 3.309 . . . . 0.0 113.559 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.8 m -61.32 132.68 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.505 1.122 . . . . 0.0 114.01 -174.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.54 142.13 33.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.207 1.403 . . . . 0.0 111.428 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 134.51 40.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.219 1.008 . . . . 0.0 111.518 172.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -137.1 150.76 48.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.244 2.217 . . . . 0.0 110.131 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.44 136.24 53.88 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.168 0.987 . . . . 0.0 111.743 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.9 t -136.98 123.03 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.693 1.597 . . . . 0.0 109.48 -170.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 86.8 m -108.24 130.89 55.14 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.824 1.25 . . . . 0.0 109.798 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -111.49 139.51 46.86 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 126.819 2.047 . . . . 0.0 108.885 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 84.7 t -132.36 126.84 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.763 1.625 . . . . 0.0 108.2 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -81.01 108.48 14.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.953 -0.467 . . . . 0.0 110.267 174.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.19 -21.6 36.38 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -170.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -159.9 -69.3 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.457 1.503 . . . . 0.0 110.396 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -136.39 5.92 2.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.805 1.642 . . . . 0.0 112.71 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -139.02 130.95 27.77 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.088 1.755 . . . . 0.0 111.015 -173.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -74.9 123.69 25.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.222 1.409 . . . . 0.0 111.712 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -129.46 151.47 50.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.439 1.495 . . . . 0.0 111.822 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.5 t -74.94 133.02 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.929 1.291 . . . . 0.0 110.074 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -81.68 7.13 13.18 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -154.1 133.31 12.58 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.2 1.4 . . . . 0.0 109.97 -176.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -70.56 -42.62 70.9 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -94.29 18.77 10.44 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.29 1.836 . . . . 0.0 112.991 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.74 -27.53 65.02 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.313 1.045 . . . . 0.0 113.475 -176.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 23.8 t -145.83 126.7 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.627 1.971 . . . . 0.0 108.043 -174.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.409 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.281 1.433 . . . . 0.0 112.199 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.736 -0.545 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -69.33 138.78 54.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.194 0.998 . . . . 0.0 112.075 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -71.87 -38.3 70.05 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -173.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.5 t -171.04 173.13 5.17 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.759 2.024 . . . . 0.0 110.623 -176.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 m -143.5 -63.08 0.4 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.528 1.531 . . . . 0.0 111.261 176.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 -84.27 0.77 Allowed Glycine 0 CA--C 1.528 0.897 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 -174.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -165.07 -51.81 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.479 1.511 . . . . 0.0 111.888 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tt -93.37 127.42 38.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.784 1.234 . . . . 0.0 109.996 175.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -119.77 174.95 6.12 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.476 1.51 . . . . 0.0 112.543 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -56.58 -40.74 75.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.094 1.358 . . . . 0.0 113.248 -170.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.62 -46.29 76.34 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.62 0.645 . . . . 0.0 112.011 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -59.77 -52.2 66.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.839 1.256 . . . . 0.0 110.148 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.82 -48.59 69.74 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.819 0.848 . . . . 0.0 111.99 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.68 -47.14 73.98 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.995 1.318 . . . . 0.0 112.302 175.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.03 -41.18 67.81 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.482 -0.761 . . . . 0.0 111.967 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.1 mt -54.81 -41.62 70.85 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.957 0.903 . . . . 0.0 110.817 172.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.0 -48.7 73.02 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.195 0.998 . . . . 0.0 112.198 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.1 -43.12 95.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.277 0.631 . . . . 0.0 112.032 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.7 t -64.48 -39.38 93.7 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.775 0.43 . . . . 0.0 111.563 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -64.43 -40.77 96.38 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.016 -1.053 . . . . 0.0 112.638 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -41.95 98.51 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.3 0.64 . . . . 0.0 111.77 174.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -59.52 -48.15 82.75 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.635 0.774 . . . . 0.0 111.086 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.51 -43.03 95.36 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.328 -0.858 . . . . 0.0 113.233 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.1 t80 -62.63 -53.6 52.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.071 0.948 . . . . 0.0 111.857 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -64.19 -35.23 80.13 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -70.44 -30.94 67.91 Favored 'General case' 0 CA--C 1.543 0.712 0 O-C-N 121.35 -0.844 . . . . 0.0 112.865 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.0 m -70.25 -44.35 68.66 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.474 0.709 . . . . 0.0 110.988 173.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 mmt -61.34 -28.48 69.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.324 1.049 . . . . 0.0 112.909 171.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -79.36 -6.68 57.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.568 1.547 . . . . 0.0 113.686 173.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.402 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 80.21 11.41 84.37 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.795 1.664 . . . . 0.0 115.572 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -167.64 134.3 2.17 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.969 1.308 . . . . 0.0 113.75 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -83.0 112.11 35.63 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 124.048 0.939 . . . . 0.0 111.003 169.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -63.3 -13.84 38.36 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 124.426 3.417 . . . . 0.0 114.402 -176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -65.99 -20.7 66.28 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.433 1.015 . . . . 0.0 113.147 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.5 t -93.03 131.35 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 125.437 1.495 . . . . 0.0 109.114 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -112.23 -1.55 15.16 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.594 1.158 . . . . 0.0 113.844 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -128.15 15.78 6.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.303 1.441 . . . . 0.0 114.335 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.1 153.59 28.63 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.879 0.872 . . . . 0.0 110.944 171.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -124.09 120.79 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.841 1.256 . . . . 0.0 109.89 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.6 m -88.85 122.63 68.91 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 125.333 1.453 . . . . 0.0 108.937 169.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.81 138.36 81.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.174 2.583 . . . . 0.0 111.469 171.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.0 p -82.55 -3.15 55.54 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -88.6 163.06 32.16 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.48 1.514 . . . . 0.0 113.216 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -139.13 164.26 30.25 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.317 1.847 . . . . 0.0 110.207 175.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -144.65 177.2 8.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.716 0.807 . . . . 0.0 112.235 176.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.69 130.26 52.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.722 1.209 . . . . 0.0 110.454 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -158.73 137.65 11.25 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.764 1.626 . . . . 0.0 110.448 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.65 30.6 8.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.55 1.14 . . . . 0.0 112.811 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.0 m120 68.65 17.88 8.86 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.831 2.052 . . . . 0.0 114.408 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -117.7 156.32 28.44 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.191 1.797 . . . . 0.0 110.431 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -89.54 128.92 36.06 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 168.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.09 148.52 27.69 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.856 1.662 . . . . 0.0 112.84 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -124.6 136.45 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.62 1.168 . . . . 0.0 109.136 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -71.9 140.53 49.3 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.404 0.682 . . . . 0.0 112.005 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.402 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 29.3 mmm -69.4 157.18 37.57 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.253 0.621 . . . . 0.0 111.902 177.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.36 153.26 44.11 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.582 -0.699 . . . . 0.0 109.481 168.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 p -60.22 -13.48 12.69 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 -169.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -71.46 -22.12 61.86 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.995 1.718 . . . . 0.0 113.685 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -125.33 21.59 7.92 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.91 2.484 . . . . 0.0 110.079 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.23 -13.59 54.28 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 116.974 1.55 . . . . 0.0 116.974 -167.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.3 m -144.75 155.46 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.454 1.902 . . . . 0.0 107.78 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -50.78 -45.0 58.92 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 112.381 -175.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.94 -53.15 56.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.669 0.788 . . . . 0.0 112.027 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -53.32 -40.94 65.22 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.39 1.076 . . . . 0.0 113.319 176.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.18 -41.82 60.86 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.02 -44.86 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 118.657 0.662 . . . . 0.0 110.113 173.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -60.04 -36.65 77.74 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.349 1.459 . . . . 0.0 112.892 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -68.22 -33.96 75.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.183 0.993 . . . . 0.0 112.86 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.07 -29.66 19.25 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.492 1.117 . . . . 0.0 113.86 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -44.51 -44.53 20.36 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 128.08 2.552 . . . . 0.0 114.624 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.76 -25.37 68.3 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 124.115 3.21 . . . . 0.0 115.666 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.433 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -109.69 -38.75 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.834 1.254 . . . . 0.0 112.108 -177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -116.63 143.04 46.11 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.302 1.441 . . . . 0.0 110.894 -169.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.2 p -64.74 154.84 35.59 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.683 0.393 . . . . 0.0 110.046 172.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -47.78 -50.77 24.74 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.684 -0.635 . . . . 0.0 111.088 174.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.7 m -58.22 -44.08 88.02 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.969 1.308 . . . . 0.0 112.453 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.59 -37.06 80.13 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.966 0.803 . . . . 0.0 112.019 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.7 mt -71.7 -49.59 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.93 0.892 . . . . 0.0 110.341 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.73 -40.2 94.25 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.325 0.511 . . . . 0.0 111.293 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -62.96 -46.2 88.84 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.77 0.828 . . . . 0.0 112.163 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -73.6 -13.9 79.99 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 123.796 0.712 . . . . 0.0 113.967 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -77.63 -51.81 10.03 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.032 1.416 . . . . 0.0 109.033 167.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.55 -44.25 96.8 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.57 -23.14 66.16 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.498 1.119 . . . . 0.0 113.867 -175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -109.56 8.46 25.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.66 1.584 . . . . 0.0 112.819 177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 66.84 26.85 9.25 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.462 1.905 . . . . 0.0 113.424 170.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -55.48 136.09 50.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.588 1.555 . . . . 0.0 110.774 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.3 t -144.96 178.33 8.11 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.18 0.992 . . . . 0.0 112.464 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.2 t -133.38 136.6 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.343 1.857 . . . . 0.0 109.075 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.6 t -142.05 127.49 18.88 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.59 1.156 . . . . 0.0 109.853 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 57.93 24.88 11.48 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 125.188 1.395 . . . . 0.0 113.04 -174.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.44 -2.64 87.44 Favored Glycine 0 N--CA 1.475 1.295 0 C-N-CA 125.973 1.749 . . . . 0.0 114.71 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -98.18 133.84 42.06 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.189 1.396 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -66.81 141.43 57.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.208 1.003 . . . . 0.0 108.959 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.412 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.67 150.9 42.51 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.799 0.839 . . . . 0.0 112.713 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.6 m -129.66 148.17 68.32 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.86 1.664 . . . . 0.0 110.229 -178.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.99 145.48 35.75 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.583 2.188 . . . . 0.0 111.234 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.94 130.53 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.924 0.89 . . . . 0.0 110.34 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.08 -168.12 25.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.706 1.622 . . . . 0.0 112.494 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -156.6 139.57 15.35 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.321 1.448 . . . . 0.0 110.71 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -159.42 145.14 10.98 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.525 1.06 . . . . 0.0 113.07 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -168.66 134.96 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.893 2.077 . . . . 0.0 109.378 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -111.31 139.73 46.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.171 0.988 . . . . 0.0 111.621 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.08 -0.11 5.39 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.092 1.357 . . . . 0.0 114.137 170.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.466 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.0 mt -71.66 118.56 14.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.193 1.797 . . . . 0.0 110.698 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -92.84 80.57 4.66 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.494 1.118 . . . . 0.0 110.435 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -69.34 -27.51 65.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.47 0.708 . . . . 0.0 112.251 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.12 -17.83 54.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.992 1.317 . . . . 0.0 113.808 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -112.53 -0.38 15.24 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.814 1.646 . . . . 0.0 112.952 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.4 p -71.15 166.19 21.98 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.059 0.943 . . . . 0.0 113.404 176.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.4 p -135.74 142.91 45.07 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.113 1.365 . . . . 0.0 110.565 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 145.41 25.66 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.871 1.268 . . . . 0.0 111.96 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -142.32 121.59 13.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.84 2.056 . . . . 0.0 109.632 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.77 134.24 50.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.825 0.85 . . . . 0.0 112.005 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.0 mm -115.1 -39.2 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 125.183 1.393 . . . . 0.0 112.174 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 t -157.86 144.18 17.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.807 0.843 . . . . 0.0 110.468 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -146.38 96.77 2.83 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 0.0 108.931 -176.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -136.78 91.83 2.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.792 1.237 . . . . 0.0 111.807 -168.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.83 -118.84 16.33 Favored Glycine 0 N--CA 1.469 0.841 0 C-N-CA 124.053 0.835 . . . . 0.0 111.519 176.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -82.0 7.16 13.92 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.2 m -131.37 135.58 47.33 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.979 1.712 . . . . 0.0 110.677 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.6 mt -140.74 138.59 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.228 1.411 . . . . 0.0 109.474 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.2 m -120.68 138.1 54.12 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.875 1.27 . . . . 0.0 111.56 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -125.23 150.57 46.9 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.687 1.995 . . . . 0.0 112.175 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -101.14 140.77 34.98 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 126.073 1.749 . . . . 0.0 107.281 168.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -114.93 123.53 49.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.892 1.677 . . . . 0.0 109.319 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 21.9 m -96.64 109.6 22.19 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 172.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.466 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.6 t -113.19 106.26 54.87 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.416 0.686 . . . . 0.0 110.657 -169.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -64.7 159.52 44.84 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.241 2.628 . . . . 0.0 111.042 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.1 p -111.07 151.13 28.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.504 0.669 . . . . 0.0 112.523 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.27 -7.03 57.98 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.124 1.37 . . . . 0.0 112.99 172.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -96.21 -8.21 33.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.263 1.425 . . . . 0.0 113.201 177.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.76 7.41 68.74 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.956 1.265 . . . . 0.0 114.46 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.0 m -75.54 155.02 85.68 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.789 1.235 . . . . 0.0 112.154 173.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -53.89 146.91 44.19 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.135 3.224 . . . . 0.0 113.187 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.8 m -60.66 129.02 39.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.427 1.091 . . . . 0.0 113.909 -174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.31 137.55 33.93 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.482 1.513 . . . . 0.0 112.073 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.45 138.57 32.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.688 0.795 . . . . 0.0 112.561 169.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -137.33 154.82 49.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 128.305 2.642 . . . . 0.0 108.03 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -125.0 138.12 54.23 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.748 1.158 . . . . 0.0 111.141 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 28.7 t -138.88 122.27 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.211 1.404 . . . . 0.0 109.871 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.3 m -110.82 130.17 55.65 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.627 1.171 . . . . 0.0 109.956 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -109.31 138.08 46.2 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.913 2.085 . . . . 0.0 108.746 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -130.65 126.41 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 125.776 1.63 . . . . 0.0 108.263 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -79.93 104.63 10.63 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.976 0.417 . . . . 0.0 110.45 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -91.71 -47.21 7.49 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.703 0.801 . . . . 0.0 112.198 -170.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -148.93 68.15 1.05 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.672 1.589 . . . . 0.0 109.769 -171.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm 63.62 11.64 5.9 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.388 1.875 . . . . 0.0 114.054 -176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -144.64 131.53 20.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.479 1.912 . . . . 0.0 110.848 -173.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.18 121.61 21.47 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -127.38 151.19 49.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.72 1.608 . . . . 0.0 111.826 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.1 t -73.7 132.15 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.876 1.27 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -81.42 5.38 17.76 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -153.26 131.99 12.34 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.085 1.354 . . . . 0.0 110.126 -174.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.94 -43.15 75.64 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.864 0.866 . . . . 0.0 113.303 -173.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.99 18.31 10.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.055 1.742 . . . . 0.0 113.067 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.84 65.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.011 0.925 . . . . 0.0 112.787 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.3 t -144.23 126.99 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 126.518 1.927 . . . . 0.0 108.646 -175.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.25 1.119 0 C-N-CA 125.197 1.399 . . . . 0.0 112.631 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.127 -0.389 . . . . 0.0 112.127 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -141.05 155.75 46.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.716 1.607 . . . . 0.0 111.869 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -77.69 147.08 35.65 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.131 0.972 . . . . 0.0 111.496 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.7 m -141.38 124.93 16.73 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.621 1.568 . . . . 0.0 109.116 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 m -68.17 -9.98 50.85 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -169.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.91 -15.32 79.36 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.088 . . . . 0.0 113.855 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -147.67 -167.39 2.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.91 1.684 . . . . 0.0 111.911 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tt -124.39 128.49 49.14 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.34 1.056 . . . . 0.0 112.476 -168.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -112.14 172.8 6.69 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.734 2.413 . . . . 0.0 112.891 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -56.64 -43.18 80.04 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 120.782 -1.199 . . . . 0.0 112.717 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -63.43 -47.04 83.55 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.489 0.716 . . . . 0.0 112.172 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -57.39 -55.03 40.0 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.839 1.256 . . . . 0.0 110.188 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.66 78.96 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.417 0.687 . . . . 0.0 111.85 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.98 -47.79 74.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.844 1.257 . . . . 0.0 111.844 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -71.98 -41.43 67.69 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.362 -0.836 . . . . 0.0 111.962 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.1 mt -55.46 -40.79 72.03 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.115 0.966 . . . . 0.0 110.925 172.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.01 -48.16 74.91 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.068 0.947 . . . . 0.0 111.806 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.93 -40.47 97.73 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.677 -0.64 . . . . 0.0 112.357 177.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -67.93 -35.71 78.91 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.716 -0.615 . . . . 0.0 111.748 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.66 80.47 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.843 -1.161 . . . . 0.0 112.457 172.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -57.2 -48.96 77.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.932 0.893 . . . . 0.0 110.356 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -63.85 -48.59 76.15 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.941 1.296 . . . . 0.0 111.316 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -65.64 -41.33 92.75 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.388 -0.82 . . . . 0.0 112.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 159' ' ' ILE . 50.0 t80 -63.77 -52.98 57.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.659 0.783 . . . . 0.0 111.56 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -68.48 -34.53 76.1 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.68 -38.79 92.44 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.141 0.882 . . . . 0.0 112.063 171.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 33.8 m -66.67 -44.43 81.87 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.528 -0.733 . . . . 0.0 110.997 175.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.2 mmt -61.33 -29.37 69.84 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.449 0.699 . . . . 0.0 112.799 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.4 m -77.45 -4.33 44.9 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.881 1.673 . . . . 0.0 113.918 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.52 4.99 85.2 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.218 1.39 . . . . 0.0 115.725 171.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -161.95 147.0 12.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.521 1.129 . . . . 0.0 113.21 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -91.95 103.13 7.38 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 124.346 1.058 . . . . 0.0 111.312 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.19 -8.93 21.77 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 124.288 3.325 . . . . 0.0 114.405 -175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -65.1 -22.15 66.91 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.518 1.053 . . . . 0.0 112.153 169.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.2 t -99.98 129.21 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.945 2.098 . . . . 0.0 108.833 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -103.33 -5.65 22.79 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -133.97 25.16 3.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.624 1.57 . . . . 0.0 113.669 -169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.72 140.22 58.72 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.263 -0.898 . . . . 0.0 111.224 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.5 t -80.82 131.81 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.778 1.231 . . . . 0.0 107.694 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.3 133.81 8.19 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.375 -169.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.12 -26.02 3.69 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.128 2.552 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 63.73 1.15 1.02 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.293 1.837 . . . . 0.0 114.801 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.53 168.75 40.37 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.771 1.653 . . . . 0.0 113.225 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 HG12 ' A' ' 53' ' ' VAL . 56.4 p -139.55 166.6 24.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.249 1.42 . . . . 0.0 112.289 -176.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -148.67 -178.38 6.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.253 1.421 . . . . 0.0 111.352 174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.82 130.99 51.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.539 1.136 . . . . 0.0 110.514 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -158.35 137.36 11.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.816 1.646 . . . . 0.0 110.572 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 53.53 29.54 9.25 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.543 1.137 . . . . 0.0 112.938 -177.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 69.84 16.98 7.69 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.838 2.055 . . . . 0.0 114.263 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.9 mt -116.37 154.81 29.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.259 1.824 . . . . 0.0 110.36 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -88.32 126.15 35.05 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -103.81 144.22 31.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.708 1.603 . . . . 0.0 112.726 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.433 HG12 HG22 ' A' ' 44' ' ' THR . 6.5 m -115.95 133.96 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.603 1.561 . . . . 0.0 109.133 172.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.96 139.7 50.68 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.995 0.918 . . . . 0.0 111.516 171.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 34.0 mmm -74.83 150.11 39.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.143 0.577 . . . . 0.0 111.731 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 52.8 m -71.88 158.97 35.08 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.69 -0.631 . . . . 0.0 111.054 170.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.8 p -51.94 -28.49 16.73 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -166.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.79 -14.84 61.61 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 120.838 1.654 . . . . 0.0 113.475 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.5 mt -124.4 19.96 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.532 2.333 . . . . 0.0 110.221 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.52 -19.11 64.32 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.528 1.537 . . . . 0.0 116.473 -167.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.6 p -134.75 161.74 34.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.17 1.388 . . . . 0.0 109.244 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -51.23 -44.87 61.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.686 0.795 . . . . 0.0 111.451 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.06 -55.54 29.83 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.789 0.836 . . . . 0.0 112.024 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.34 -37.88 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.721 1.146 . . . . 0.0 113.975 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -42.49 62.05 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.11 -41.34 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 CA-C-N 118.776 0.716 . . . . 0.0 110.39 173.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.27 -36.45 83.7 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.359 1.464 . . . . 0.0 112.771 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -69.25 -33.81 73.83 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.281 1.032 . . . . 0.0 112.748 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.94 -26.42 22.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.63 1.172 . . . . 0.0 113.704 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.45 -45.37 32.0 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.517 2.327 . . . . 0.0 114.392 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -57.13 -26.27 68.38 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 124.127 3.218 . . . . 0.0 115.659 176.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -110.04 -34.79 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.871 1.268 . . . . 0.0 112.679 -173.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -122.81 142.49 50.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.523 1.529 . . . . 0.0 110.344 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.3 p -65.77 156.31 33.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.003 0.521 . . . . 0.0 109.913 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -51.72 -49.87 61.68 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.437 -0.789 . . . . 0.0 111.393 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.7 t -62.1 -35.56 79.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.635 1.174 . . . . 0.0 112.849 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.56 98.72 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.121 0.873 . . . . 0.0 112.056 173.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 42.2 mt -67.38 -47.77 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 123.732 0.813 . . . . 0.0 110.534 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -59.87 -43.23 94.82 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.518 0.599 . . . . 0.0 111.666 177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.76 -45.75 93.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.689 0.796 . . . . 0.0 112.256 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.87 -17.31 80.16 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.749 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -75.54 -47.1 28.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.326 1.563 . . . . 0.0 109.624 168.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -62.33 -47.4 84.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.549 -0.72 . . . . 0.0 112.663 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.11 -23.85 64.96 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -109.27 9.35 25.86 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.483 1.513 . . . . 0.0 112.99 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 65.22 30.82 11.15 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.9 1.68 . . . . 0.0 113.14 169.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.04 130.43 46.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.417 1.487 . . . . 0.0 110.509 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -139.41 178.37 7.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.915 0.886 . . . . 0.0 112.729 -169.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.87 136.09 57.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 126.349 1.86 . . . . 0.0 109.15 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.3 t -141.71 134.64 28.87 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.657 1.183 . . . . 0.0 109.034 169.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp 60.34 19.01 8.58 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.605 1.162 . . . . 0.0 114.009 -175.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.12 1.02 86.82 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 125.806 1.669 . . . . 0.0 114.187 -174.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -107.56 137.23 45.96 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.595 1.958 . . . . 0.0 110.88 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -68.36 142.35 55.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.981 0.913 . . . . 0.0 109.671 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.438 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.52 152.1 43.85 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.0 0.92 . . . . 0.0 112.418 169.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 24.4 m -132.34 150.29 75.54 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.915 1.686 . . . . 0.0 110.117 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.9 144.8 48.93 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.363 2.042 . . . . 0.0 111.063 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -62.72 133.23 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.093 0.957 . . . . 0.0 111.455 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.63 151.17 22.95 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.485 1.993 . . . . 0.0 111.319 170.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -72.73 -40.12 66.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.583 0.691 . . . . 0.0 112.83 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.2 94.83 0.08 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.29 1.9 . . . . 0.0 114.326 170.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -167.09 158.28 12.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.832 1.653 . . . . 0.0 111.655 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -143.88 142.31 30.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.547 1.139 . . . . 0.0 110.623 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -6.4 25.49 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 171.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.459 ' HB3' HG11 ' A' ' 128' ' ' VAL . 18.6 mt -71.5 132.64 45.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.187 1.795 . . . . 0.0 111.626 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -107.34 87.76 2.58 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.578 1.551 . . . . 0.0 110.527 175.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -74.13 -26.18 60.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.8 0.84 . . . . 0.0 112.408 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.55 -17.61 60.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.524 1.129 . . . . 0.0 113.527 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -111.32 0.52 16.7 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.957 1.703 . . . . 0.0 112.966 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.4 p -72.25 167.28 20.7 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.797 0.839 . . . . 0.0 113.219 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.8 p -134.51 142.43 47.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.072 1.349 . . . . 0.0 110.644 176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.03 146.1 25.32 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.762 1.225 . . . . 0.0 112.885 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -137.09 122.81 19.88 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.229 2.612 . . . . 0.0 108.995 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.39 133.9 50.45 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.181 0.9 . . . . 0.0 111.085 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.8 mm -112.91 -39.84 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.547 1.539 . . . . 0.0 112.182 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.3 t -159.95 141.26 12.56 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.515 0.726 . . . . 0.0 110.913 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -139.01 98.33 3.5 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.972 1.309 . . . . 0.0 109.288 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -135.83 91.91 2.75 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 111.981 -169.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.85 -120.37 21.95 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.987 0.803 . . . . 0.0 111.522 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.8 m -82.08 6.78 15.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.8 m -130.98 136.18 48.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.063 1.745 . . . . 0.0 110.651 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 99.3 mt -140.97 139.54 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.354 1.462 . . . . 0.0 109.555 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.3 m -121.68 137.78 54.61 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.425 1.09 . . . . 0.0 111.563 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -123.63 150.19 44.47 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.38 1.872 . . . . 0.0 112.056 171.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.31 146.3 27.75 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 126.728 2.011 . . . . 0.0 107.549 168.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -125.13 122.27 36.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.998 1.719 . . . . 0.0 109.509 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 22.6 m -94.14 105.69 17.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.459 HG11 ' HB3' ' A' ' 105' ' ' LEU . 8.2 t -109.09 106.11 58.26 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 123.563 0.745 . . . . 0.0 110.684 -169.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.87 160.86 38.94 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.391 2.728 . . . . 0.0 111.265 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 11.6 p -112.34 152.31 28.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.8 0.81 . . . . 0.0 112.466 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -83.59 -6.18 59.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.794 1.638 . . . . 0.0 112.417 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -95.45 -7.94 36.81 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.648 1.579 . . . . 0.0 113.123 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.63 7.23 66.98 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.14 1.352 . . . . 0.0 114.463 177.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -78.91 155.17 77.91 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.87 1.268 . . . . 0.0 112.244 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.58 149.34 39.96 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.061 3.174 . . . . 0.0 113.043 173.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.9 m -61.06 129.14 39.9 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.02 135.74 34.75 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.52 1.528 . . . . 0.0 111.785 -177.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 132.71 34.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.384 0.673 . . . . 0.0 112.272 169.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -128.48 155.14 45.29 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.709 2.403 . . . . 0.0 108.31 172.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.97 137.69 54.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.204 1.001 . . . . 0.0 110.825 175.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.9 t -137.99 118.43 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.322 1.449 . . . . 0.0 109.55 -171.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.3 m -107.06 132.48 52.93 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.774 1.23 . . . . 0.0 109.561 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -112.8 140.82 47.26 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.749 2.02 . . . . 0.0 108.829 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.14 127.63 60.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.844 1.658 . . . . 0.0 107.92 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -81.23 108.26 14.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.83 0.452 . . . . 0.0 110.12 175.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -81.58 -20.66 39.42 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -170.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -159.72 -69.45 0.08 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.446 1.498 . . . . 0.0 110.463 177.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -136.9 9.17 3.04 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.823 1.649 . . . . 0.0 112.407 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -142.54 130.45 21.74 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.3 1.84 . . . . 0.0 111.094 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.2 122.08 23.1 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.402 1.481 . . . . 0.0 112.081 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -126.8 151.89 47.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.812 1.645 . . . . 0.0 111.546 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.0 t -73.35 132.58 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.5 1.12 . . . . 0.0 110.086 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -81.36 5.01 18.72 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -153.13 131.0 11.7 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.144 1.378 . . . . 0.0 109.823 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -67.86 -45.22 75.18 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.426 0.69 . . . . 0.0 112.786 -174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.78 17.74 6.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.612 1.565 . . . . 0.0 113.392 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.09 -29.33 67.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.002 0.921 . . . . 0.0 113.039 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 63.8 t -143.57 120.93 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 126.056 1.742 . . . . 0.0 109.457 -173.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 24' ' ' PHE . 2.0 pt . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.074 -1.441 . . . . 0.0 113.477 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -71.97 -27.25 62.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -176.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.3 t30 71.58 136.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.288 2.635 . . . . 0.0 113.251 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.4 t -168.87 172.76 7.51 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.162 2.185 . . . . 0.0 110.293 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -142.86 6.49 1.6 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.914 1.686 . . . . 0.0 113.758 -176.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -83.96 -8.76 83.65 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.591 1.091 . . . . 0.0 114.771 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -102.05 160.17 14.73 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.669 1.588 . . . . 0.0 112.74 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.79 133.34 34.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 0.0 110.762 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.7 p -109.26 172.64 6.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.422 1.889 . . . . 0.0 113.555 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -57.77 -42.49 84.17 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.91 -1.119 . . . . 0.0 112.003 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -52.65 61.66 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.774 0.83 . . . . 0.0 111.597 177.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.97 -52.1 64.12 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.092 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.74 -49.4 75.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.704 1.138 . . . . 0.0 111.996 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -54.59 -46.93 73.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.816 1.247 . . . . 0.0 111.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -73.07 -41.59 63.95 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.495 -0.753 . . . . 0.0 111.886 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.9 mt -54.73 -40.51 69.33 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.002 0.921 . . . . 0.0 110.895 172.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.26 72.21 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.259 1.024 . . . . 0.0 111.974 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -62.96 -40.64 98.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.304 0.641 . . . . 0.0 112.14 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -67.59 -35.32 78.78 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.765 -0.584 . . . . 0.0 111.768 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.96 81.2 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 120.981 -1.074 . . . . 0.0 112.58 172.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -56.57 -50.0 73.19 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.682 0.793 . . . . 0.0 110.348 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.89 -50.99 68.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.97 1.308 . . . . 0.0 111.581 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -65.41 -38.98 91.56 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.376 -0.828 . . . . 0.0 112.943 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.416 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.2 t80 -64.07 -54.06 39.94 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.602 0.761 . . . . 0.0 111.513 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -65.89 -35.26 80.16 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.43 -38.79 92.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.042 0.837 . . . . 0.0 112.328 172.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.9 m -68.26 -43.08 78.61 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.595 -0.691 . . . . 0.0 111.132 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -60.78 -27.43 67.99 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.005 0.922 . . . . 0.0 112.961 171.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -81.2 -2.15 47.53 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.963 1.705 . . . . 0.0 113.782 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.17 87.1 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.316 1.436 . . . . 0.0 115.544 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -163.15 139.2 6.99 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.807 1.243 . . . . 0.0 113.363 -169.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -89.73 105.81 12.14 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.874 1.27 . . . . 0.0 111.855 172.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -63.17 -8.9 15.42 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.489 3.459 . . . . 0.0 113.968 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.5 -24.38 63.58 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.163 0.985 . . . . 0.0 112.053 167.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 75.1 t -101.92 133.61 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.993 2.117 . . . . 0.0 109.229 173.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -104.41 131.65 51.54 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.736 1.214 . . . . 0.0 110.2 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt 67.38 37.37 3.55 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.959 1.704 . . . . 0.0 113.889 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.08 151.91 25.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.821 0.848 . . . . 0.0 110.485 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.6 t -81.88 113.4 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 85.7 m -112.69 112.12 51.17 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 125.256 1.422 . . . . 0.0 110.261 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -62.17 137.55 66.9 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.966 2.444 . . . . 0.0 111.648 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.3 p -88.15 -2.63 58.72 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.82 162.52 32.85 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.491 1.519 . . . . 0.0 113.52 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.3 p -143.03 167.58 21.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.709 2.004 . . . . 0.0 110.132 175.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -147.85 178.16 8.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.956 0.902 . . . . 0.0 112.029 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -123.13 131.48 53.71 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.708 1.203 . . . . 0.0 110.666 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -157.44 135.81 11.19 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.962 1.705 . . . . 0.0 110.13 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 55.93 28.57 12.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.522 1.129 . . . . 0.0 112.765 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.1 16.07 8.66 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.811 2.045 . . . . 0.0 114.057 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 mt -113.59 155.48 25.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.06 1.744 . . . . 0.0 110.293 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -89.18 130.31 35.63 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -107.58 144.34 34.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.793 1.637 . . . . 0.0 112.393 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.4 m -117.9 139.29 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.109 1.364 . . . . 0.0 109.658 176.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -74.55 143.75 44.34 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.624 0.769 . . . . 0.0 112.386 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.0 mmm -76.15 153.23 36.37 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.552 0.741 . . . . 0.0 111.385 176.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.7 m -70.5 161.16 31.1 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.687 -0.633 . . . . 0.0 111.647 172.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -51.39 -31.12 21.38 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -167.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.01 -5.06 58.05 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.894 1.679 . . . . 0.0 113.778 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.3 mt -123.36 18.81 9.78 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.15 2.18 . . . . 0.0 109.828 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.63 -18.53 66.03 Favored Glycine 0 N--CA 1.472 1.05 0 N-CA-C 116.965 1.546 . . . . 0.0 116.965 -167.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -138.06 166.97 22.77 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.529 1.532 . . . . 0.0 109.426 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -49.51 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.185 0.594 . . . . 0.0 111.505 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.25 -53.4 57.66 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.748 0.819 . . . . 0.0 111.746 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -55.86 -39.57 71.67 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.99 -39.61 61.15 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.3 t -58.38 -44.6 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.39 0.676 . . . . 0.0 109.713 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.66 -37.51 73.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.831 1.252 . . . . 0.0 113.357 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -68.35 -34.69 76.54 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.238 -0.914 . . . . 0.0 112.925 174.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.69 -28.85 20.31 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.675 1.19 . . . . 0.0 113.758 -175.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.15 -45.15 27.55 Favored Pre-proline 0 N--CA 1.474 0.734 0 C-N-CA 127.979 2.512 . . . . 0.0 114.42 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -57.77 -24.66 64.8 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.961 3.108 . . . . 0.0 115.628 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.8 mm -110.65 -36.47 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.781 1.233 . . . . 0.0 112.386 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -122.19 142.91 49.93 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.73 1.612 . . . . 0.0 110.42 -169.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 62.7 p -64.49 153.27 39.45 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -50.19 -46.26 54.24 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.704 -0.623 . . . . 0.0 111.394 178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 77.4 m -62.53 -42.97 99.87 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.045 1.338 . . . . 0.0 112.66 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.56 76.03 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.414 1.006 . . . . 0.0 112.218 176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -69.8 -49.48 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 123.832 0.853 . . . . 0.0 109.917 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.46 -41.77 90.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.159 0.436 . . . . 0.0 111.777 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.01 -45.68 92.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.816 0.847 . . . . 0.0 112.284 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.14 -33.3 65.12 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-N 118.633 0.651 . . . . 0.0 112.313 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.43 -42.04 99.15 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.267 1.533 . . . . 0.0 111.216 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -66.92 -44.75 79.91 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.194 -0.941 . . . . 0.0 112.683 172.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.84 -29.15 68.22 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -105.2 7.33 33.6 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.206 1.403 . . . . 0.0 112.97 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 68.83 25.56 6.17 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.462 1.905 . . . . 0.0 113.991 169.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -53.33 129.91 33.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.353 1.461 . . . . 0.0 110.352 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -136.1 -176.33 4.28 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -169.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 80.3 t -137.54 135.75 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 126.516 1.926 . . . . 0.0 108.224 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.8 t -142.11 127.96 19.38 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.639 1.175 . . . . 0.0 109.839 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt 57.41 24.91 10.7 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.019 1.328 . . . . 0.0 113.172 -173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.42 -4.81 85.76 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.988 1.756 . . . . 0.0 114.689 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -96.1 134.56 39.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.324 1.449 . . . . 0.0 111.04 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -64.51 141.04 58.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.888 0.875 . . . . 0.0 109.126 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.429 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -140.08 153.84 46.87 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.7 m -132.82 148.3 68.93 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 125.983 1.713 . . . . 0.0 110.165 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -73.21 145.49 39.06 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.629 2.219 . . . . 0.0 111.176 -178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.5 mt -67.22 133.44 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.031 0.932 . . . . 0.0 110.317 174.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -166.9 -165.77 24.86 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 125.726 1.632 . . . . 0.0 112.61 176.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -156.37 140.15 16.12 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.559 1.544 . . . . 0.0 110.535 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -152.71 145.64 13.39 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.453 1.025 . . . . 0.0 113.302 -177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -169.32 150.98 4.41 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.228 2.211 . . . . 0.0 109.588 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -136.07 140.05 43.49 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.468 1.107 . . . . 0.0 111.496 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.71 -3.81 10.35 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.716 1.207 . . . . 0.0 114.088 170.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.43 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.7 mt -69.1 120.64 15.27 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.973 1.709 . . . . 0.0 110.628 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -98.57 82.26 2.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.776 1.23 . . . . 0.0 110.712 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -68.88 -26.72 65.26 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.619 0.768 . . . . 0.0 112.06 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.79 60.24 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.953 1.301 . . . . 0.0 113.761 173.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -112.95 0.8 15.19 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.777 1.631 . . . . 0.0 113.012 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.4 p -71.53 166.97 20.68 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -133.18 142.56 48.69 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.056 1.343 . . . . 0.0 110.565 176.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.53 143.72 27.27 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.678 1.191 . . . . 0.0 112.5 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.9 tttt -134.57 123.77 24.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 128.095 2.558 . . . . 0.0 109.12 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.0 tp -67.23 133.48 49.82 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.006 0.821 . . . . 0.0 111.265 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.4 mm -113.94 -38.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.59 1.556 . . . . 0.0 112.191 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 t -158.19 140.85 14.6 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.498 0.719 . . . . 0.0 110.82 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' HE2' HD13 ' A' ' 122' ' ' ILE . 30.4 ttmt -140.88 97.05 3.11 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.811 1.244 . . . . 0.0 109.143 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.06 91.02 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.672 1.189 . . . . 0.0 111.796 -168.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.46 -118.78 15.93 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.083 0.849 . . . . 0.0 111.326 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.9 m -83.61 6.4 20.84 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.4 m -129.71 136.92 50.25 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.947 1.699 . . . . 0.0 110.585 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.411 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.6 mt -140.9 140.36 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.327 1.451 . . . . 0.0 109.582 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -122.2 136.43 54.91 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.891 1.277 . . . . 0.0 111.375 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -122.94 148.67 45.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.114 1.766 . . . . 0.0 112.054 170.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.61 144.9 27.4 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.646 1.979 . . . . 0.0 107.306 168.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -121.51 120.54 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 125.984 1.714 . . . . 0.0 109.431 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 59.7 m -94.74 104.45 16.37 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.3 t -108.24 105.32 56.35 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.869 -169.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.95 159.16 47.63 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.598 2.865 . . . . 0.0 111.233 174.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 14.4 p -108.55 153.38 23.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.4 mt -80.66 -4.83 55.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.44 1.496 . . . . 0.0 112.976 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -101.95 -7.64 22.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.416 1.486 . . . . 0.0 113.342 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.3 5.28 67.59 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.996 1.284 . . . . 0.0 114.393 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.1 m -73.04 152.59 90.75 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.782 1.233 . . . . 0.0 111.747 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.45 151.55 84.63 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 123.45 2.767 . . . . 0.0 111.659 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.1 m -59.84 130.08 45.0 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -170.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 136.44 34.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.4 1.48 . . . . 0.0 111.929 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.6 122.42 29.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.096 0.958 . . . . 0.0 112.014 169.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -117.62 158.87 23.87 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 127.889 2.476 . . . . 0.0 108.879 169.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -128.19 138.76 52.61 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.154 0.982 . . . . 0.0 111.042 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 43.7 t -138.85 122.32 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.295 1.438 . . . . 0.0 109.648 -171.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.2 m -109.55 137.87 46.76 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.756 1.223 . . . . 0.0 109.906 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -122.42 144.73 48.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.644 1.978 . . . . 0.0 109.125 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.8 t -132.48 128.79 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.531 1.533 . . . . 0.0 108.381 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -80.6 107.89 13.78 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 122.613 0.365 . . . . 0.0 110.177 173.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -95.85 -45.81 6.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.364 0.666 . . . . 0.0 112.196 -170.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -150.42 69.78 1.0 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.414 1.486 . . . . 0.0 109.937 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm 61.37 18.27 9.13 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.858 1.663 . . . . 0.0 113.748 -177.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.73 134.67 12.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.265 1.826 . . . . 0.0 111.307 -174.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -73.93 126.98 31.66 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.492 1.917 . . . . 0.0 111.963 173.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -132.2 151.9 51.57 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.261 1.824 . . . . 0.0 111.358 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 8.8 t -72.14 133.84 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.007 1.323 . . . . 0.0 110.092 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -82.48 6.54 17.03 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -153.35 132.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.184 1.393 . . . . 0.0 110.161 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -68.33 -43.36 77.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.922 0.889 . . . . 0.0 113.268 -173.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.99 20.42 10.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.166 1.786 . . . . 0.0 112.973 -178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.42 65.84 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.075 . . . . 0.0 113.511 -176.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.1 t -146.11 119.07 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 126.46 1.904 . . . . 0.0 109.195 -172.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.416 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.5 pt . . . . . 0 C--O 1.249 1.076 0 C-N-CA 125.876 1.671 . . . . 0.0 113.058 -176.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? 74.01 121.56 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 128.022 2.529 . . . . 0.0 112.336 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -151.96 139.16 19.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.201 1.4 . . . . 0.0 111.104 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.5 m -150.55 131.74 14.48 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.994 1.718 . . . . 0.0 109.037 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.5 m -161.71 117.5 2.06 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 0.0 110.694 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -102.16 0.3 50.97 Favored Glycine 0 N--CA 1.478 1.436 0 C-N-CA 125.076 1.322 . . . . 0.0 113.853 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -102.6 169.3 8.73 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.119 2.167 . . . . 0.0 113.162 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tt -95.1 130.38 41.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.298 1.439 . . . . 0.0 111.262 -169.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -107.41 169.74 8.39 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.338 2.255 . . . . 0.0 113.352 -177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -56.52 -42.08 77.82 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.89 -1.131 . . . . 0.0 111.954 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -62.74 -48.99 76.83 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.576 0.751 . . . . 0.0 111.724 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -56.92 -54.56 45.24 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.92 0.888 . . . . 0.0 110.709 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -47.52 81.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.828 0.74 . . . . 0.0 111.765 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.84 -45.97 78.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.64 1.176 . . . . 0.0 111.717 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -72.71 -41.94 64.69 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 121.346 -0.846 . . . . 0.0 111.876 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.2 mt -55.9 -39.43 71.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.084 0.954 . . . . 0.0 110.975 172.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.13 -50.21 66.91 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.381 1.073 . . . . 0.0 111.426 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.7 mt -58.53 -42.88 88.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.217 0.607 . . . . 0.0 112.135 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -66.51 -36.1 81.88 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.943 0.497 . . . . 0.0 111.965 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -38.78 79.35 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.852 -1.155 . . . . 0.0 112.569 176.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -45.28 93.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.038 0.835 . . . . 0.0 110.944 169.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.29 -49.23 78.43 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.358 0.663 . . . . 0.0 111.905 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -68.4 -35.42 77.64 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.181 -0.95 . . . . 0.0 113.299 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.45 -56.25 19.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.086 0.954 . . . . 0.0 110.707 174.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -67.27 -32.28 73.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.587 -0.696 . . . . 0.0 112.792 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -67.71 -13.08 61.8 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 170.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.8 m -93.6 -53.55 4.0 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.519 1.128 . . . . 0.0 110.329 169.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 88.6 mmm -61.42 -21.03 63.74 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.8 t -71.93 -12.48 61.27 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.93 -6.15 83.93 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.115 1.34 . . . . 0.0 113.979 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -157.0 140.78 16.07 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 -177.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -92.67 105.27 13.95 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.722 1.209 . . . . 0.0 111.364 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.96 -10.71 21.37 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.144 3.23 . . . . 0.0 114.768 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -64.05 -17.9 63.82 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.467 1.031 . . . . 0.0 112.602 168.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -109.68 133.04 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.494 1.918 . . . . 0.0 109.573 169.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -114.03 -0.98 13.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.977 1.311 . . . . 0.0 113.336 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -137.18 22.63 3.01 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.243 1.817 . . . . 0.0 113.056 -174.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.35 146.05 55.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.942 0.897 . . . . 0.0 110.984 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 68.0 t -77.78 114.6 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.6 m -112.11 114.6 51.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 124.366 1.066 . . . . 0.0 111.332 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.92 139.35 30.04 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.174 2.583 . . . . 0.0 110.399 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -94.23 -1.27 54.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -85.12 156.01 30.54 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.137 1.351 . . . . 0.0 113.643 -177.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.3 p -139.39 165.51 27.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.367 1.867 . . . . 0.0 110.445 174.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -149.48 -179.23 6.92 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.416 1.086 . . . . 0.0 111.736 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -124.65 130.27 52.1 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.403 1.081 . . . . 0.0 110.615 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -158.23 139.02 12.96 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.771 1.628 . . . . 0.0 110.687 -174.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 52.53 30.67 8.78 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 112.986 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 66.13 25.73 10.72 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.596 1.958 . . . . 0.0 114.371 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.3 mt -126.23 155.84 41.2 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.685 1.994 . . . . 0.0 110.132 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.26 127.17 35.46 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -103.75 141.63 35.76 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.855 1.662 . . . . 0.0 112.805 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m -113.23 135.11 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.448 1.499 . . . . 0.0 109.275 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -73.57 141.08 46.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.821 0.849 . . . . 0.0 111.64 170.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.3 mmm -76.77 151.84 35.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.532 0.733 . . . . 0.0 112.466 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.1 m -73.21 165.76 24.44 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.616 -0.678 . . . . 0.0 111.69 169.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.8 p -58.4 -20.24 42.64 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 117.707 2.484 . . . . 0.0 117.707 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -72.35 -17.62 61.82 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.948 1.704 . . . . 0.0 113.465 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 mt -131.69 21.7 4.65 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.141 2.176 . . . . 0.0 110.62 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.14 -19.54 66.15 Favored Glycine 0 CA--C 1.532 1.126 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -167.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 8.3 p -137.06 165.7 25.42 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.478 1.511 . . . . 0.0 109.59 173.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -48.23 -48.07 35.37 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.576 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.31 -53.46 57.84 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.647 0.779 . . . . 0.0 111.628 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 mtpt -54.97 -39.14 68.67 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.495 1.043 . . . . 0.0 113.444 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.04 -40.76 60.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -61.88 -40.64 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.611 0.641 . . . . 0.0 110.823 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.39 -38.85 85.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.15 1.38 . . . . 0.0 112.486 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.07 -34.38 76.33 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.405 -0.809 . . . . 0.0 112.848 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.47 -26.86 21.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.621 1.169 . . . . 0.0 113.677 -175.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.37 -44.71 41.32 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 127.743 2.417 . . . . 0.0 114.462 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.97 -26.0 72.77 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.999 3.133 . . . . 0.0 115.605 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 mm -110.6 -36.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.773 1.229 . . . . 0.0 112.794 -172.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -117.3 143.99 45.34 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.243 1.417 . . . . 0.0 110.336 -172.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.2 p -64.5 152.99 40.31 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -54.07 -47.09 72.07 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.652 -0.655 . . . . 0.0 111.947 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.9 t -63.68 -36.92 85.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.045 1.738 . . . . 0.0 113.503 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -37.19 84.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.728 1.149 . . . . 0.0 112.59 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.9 mt -67.19 -47.98 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.722 0.809 . . . . 0.0 110.142 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -60.59 -40.66 92.57 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.33 -43.89 98.11 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.871 0.868 . . . . 0.0 112.278 176.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.08 -34.59 64.7 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.814 0.734 . . . . 0.0 112.389 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -61.79 -41.71 98.07 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.341 1.571 . . . . 0.0 110.814 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.64 -44.13 82.77 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.321 -0.862 . . . . 0.0 112.672 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -67.6 -28.83 68.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -105.67 9.59 33.14 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.171 1.388 . . . . 0.0 113.029 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 65.77 29.81 10.45 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.905 1.682 . . . . 0.0 113.077 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -55.38 132.91 49.28 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.416 1.486 . . . . 0.0 110.548 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.2 t -135.24 178.19 7.22 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.536 1.135 . . . . 0.0 111.863 -172.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -137.64 134.97 46.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 126.141 1.776 . . . . 0.0 108.185 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.0 t -143.34 126.0 15.97 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.349 1.06 . . . . 0.0 109.889 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.4 tptp 57.79 23.81 10.05 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 125.313 1.445 . . . . 0.0 113.307 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.02 -5.76 84.59 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.035 1.779 . . . . 0.0 114.547 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.15 135.09 34.01 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.759 1.279 . . . . 0.0 110.628 176.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 95' ' ' ALA . 2.1 tt -66.16 141.05 58.22 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.835 0.854 . . . . 0.0 109.023 172.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.44 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -139.68 153.06 47.17 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.539 0.736 . . . . 0.0 112.644 169.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.21 151.46 73.47 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.563 1.545 . . . . 0.0 110.173 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.73 146.44 48.53 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.401 2.068 . . . . 0.0 111.459 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.18 134.5 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.171 0.988 . . . . 0.0 111.478 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.51 153.66 24.99 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.451 1.977 . . . . 0.0 111.634 170.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -73.19 -36.17 66.5 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -176.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.72 168.54 34.39 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 125.525 1.536 . . . . 0.0 115.484 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.0 t0 72.26 161.26 0.24 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 128.372 2.669 . . . . 0.0 113.406 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -129.75 155.53 45.77 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.864 1.666 . . . . 0.0 112.006 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -2.2 13.57 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.644 1.177 . . . . 0.0 114.129 170.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.45 ' HB3' HG11 ' A' ' 128' ' ' VAL . 52.9 mt -72.66 117.65 14.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.078 1.751 . . . . 0.0 110.28 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -90.17 82.87 6.0 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.036 0.934 . . . . 0.0 110.455 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -69.39 -25.72 64.29 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.456 0.703 . . . . 0.0 112.159 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.49 -16.7 64.33 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.742 1.217 . . . . 0.0 113.673 174.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -110.43 0.09 17.71 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.473 1.509 . . . . 0.0 112.961 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.0 p -69.48 165.01 21.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.112 0.965 . . . . 0.0 113.145 174.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.6 p -134.51 139.14 45.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.524 1.13 . . . . 0.0 111.125 176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.84 22.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.967 1.307 . . . . 0.0 113.307 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -141.07 123.59 15.92 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.008 2.523 . . . . 0.0 109.488 -176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -68.35 133.49 48.81 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.204 0.911 . . . . 0.0 111.314 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.1 mm -111.03 -41.06 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 125.505 1.522 . . . . 0.0 112.291 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -159.73 143.3 14.38 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.655 0.782 . . . . 0.0 111.151 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -136.11 100.82 4.52 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.64 1.176 . . . . 0.0 110.9 -176.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -102.55 -178.05 3.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.116 1.766 . . . . 0.0 110.843 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.48 93.12 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.0 0.809 . . . . 0.0 114.309 -175.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.4 m -139.33 9.33 2.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.4 m -137.98 133.65 33.93 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.305 1.842 . . . . 0.0 109.196 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.3 mt -140.99 137.74 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.719 1.208 . . . . 0.0 109.518 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.9 m -119.96 135.17 55.01 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.267 1.027 . . . . 0.0 110.82 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -122.41 148.22 45.36 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.089 1.755 . . . . 0.0 111.741 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -101.43 147.99 25.7 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.265 1.826 . . . . 0.0 108.48 169.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -130.88 126.0 35.04 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.624 1.97 . . . . 0.0 109.491 -173.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 37.8 m -102.27 116.85 33.5 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 170.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.45 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.6 t -116.87 105.94 48.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.871 0.869 . . . . 0.0 110.673 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.94 160.29 42.02 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.397 2.731 . . . . 0.0 111.235 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -111.76 152.5 27.75 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.535 0.683 . . . . 0.0 112.589 -175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.7 mt -80.56 -5.41 56.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.17 1.388 . . . . 0.0 112.85 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -100.06 -7.25 25.2 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.51 1.524 . . . . 0.0 113.174 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.17 7.87 69.47 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.996 1.284 . . . . 0.0 114.495 177.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.3 m -75.88 154.78 85.03 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 112.2 173.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -53.86 144.76 54.04 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 124.054 3.169 . . . . 0.0 113.072 174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.4 m -63.24 126.86 28.8 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.184 0.994 . . . . 0.0 113.49 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.13 139.31 38.07 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.852 1.661 . . . . 0.0 112.121 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -96.93 136.14 37.91 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.023 0.929 . . . . 0.0 111.658 177.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -137.94 151.75 48.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.398 2.279 . . . . 0.0 110.13 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.74 133.6 53.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.391 1.076 . . . . 0.0 111.04 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.1 t -134.1 122.62 41.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.593 1.557 . . . . 0.0 109.55 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 96.6 m -110.89 133.64 53.2 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.518 1.127 . . . . 0.0 109.991 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -115.94 140.85 48.84 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.646 1.979 . . . . 0.0 108.871 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 78.4 t -130.58 127.95 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.949 1.7 . . . . 0.0 107.949 -178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -79.68 103.49 9.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.76 0.314 . . . . 0.0 110.601 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -85.29 -43.12 14.0 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.292 0.637 . . . . 0.0 112.181 -171.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -163.02 93.98 0.82 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.098 1.359 . . . . 0.0 110.146 177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 61.11 4.42 0.85 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.025 1.33 . . . . 0.0 114.262 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -143.28 125.99 16.01 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.038 1.735 . . . . 0.0 111.575 -170.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.58 117.34 15.22 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.205 1.402 . . . . 0.0 111.404 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -122.73 151.82 41.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.787 1.635 . . . . 0.0 112.0 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.1 t -74.11 132.38 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.583 1.153 . . . . 0.0 110.441 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -83.02 7.78 14.69 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.29 131.79 11.32 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.03 1.332 . . . . 0.0 109.816 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -67.29 -47.27 71.09 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.64 0.776 . . . . 0.0 112.88 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -87.13 15.61 5.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.262 1.425 . . . . 0.0 113.464 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.48 -32.58 71.55 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.981 0.912 . . . . 0.0 112.988 -176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.7 t -144.97 118.89 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.498 0 C-N-CA 126.015 1.726 . . . . 0.0 108.851 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.7 pt . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.502 -1.713 . . . . 0.0 112.268 -174.039 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -90.69 -20.52 22.38 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.114 0.965 . . . . 0.0 113.578 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -113.08 6.37 17.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.236 1.814 . . . . 0.0 113.914 -177.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -94.09 19.18 9.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.619 1.967 . . . . 0.0 113.429 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.8 p -67.22 -14.18 62.66 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.5 -2.03 68.14 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.31 1.433 . . . . 0.0 114.181 170.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -112.17 161.55 16.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.924 1.69 . . . . 0.0 111.792 -176.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -90.98 139.87 30.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.587 1.155 . . . . 0.0 110.7 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 t -135.21 172.34 13.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.226 1.81 . . . . 0.0 111.277 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -54.11 -45.31 71.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.766 1.226 . . . . 0.0 113.405 -170.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -59.73 -52.56 64.97 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.585 0.754 . . . . 0.0 111.347 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -57.33 -50.33 73.3 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.186 -0.912 . . . . 0.0 110.653 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.46 73.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.564 1.074 . . . . 0.0 111.887 177.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.86 -47.33 74.35 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.827 1.251 . . . . 0.0 112.051 177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -72.43 -38.85 68.22 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.298 -0.876 . . . . 0.0 112.635 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 mt -57.43 -39.65 76.7 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.89 0.876 . . . . 0.0 110.68 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.78 -48.67 71.04 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.254 1.021 . . . . 0.0 111.54 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.5 -39.41 93.41 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.665 -0.647 . . . . 0.0 112.437 176.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 13.8 t -66.99 -36.7 82.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.659 -0.65 . . . . 0.0 111.813 174.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.54 -34.98 78.18 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.787 -1.196 . . . . 0.0 112.415 172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -57.8 -49.51 76.38 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.781 0.833 . . . . 0.0 110.313 169.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.96 -47.89 81.25 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.788 1.235 . . . . 0.0 111.458 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -67.96 -35.53 78.53 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.254 -0.904 . . . . 0.0 113.186 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -62.69 -56.62 15.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.881 0.872 . . . . 0.0 110.637 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -66.93 -33.09 74.82 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -65.96 -19.33 65.83 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 171.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 45.6 m -90.8 -49.94 6.17 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.903 0.881 . . . . 0.0 110.356 173.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.8 mmm -62.92 -18.93 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.7 t -79.53 -4.15 50.08 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.588 1.155 . . . . 0.0 113.913 173.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 88.97 -8.98 78.5 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.314 1.435 . . . . 0.0 114.825 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -166.87 138.4 3.35 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.192 1.797 . . . . 0.0 112.348 -174.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -88.57 105.56 10.07 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.589 1.555 . . . . 0.0 111.849 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -62.38 -13.88 35.45 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 124.414 3.409 . . . . 0.0 114.474 -173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -57.43 -24.7 57.16 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.733 1.213 . . . . 0.0 113.173 168.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.8 t -97.04 121.79 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.617 1.567 . . . . 0.0 109.154 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -104.31 -2.37 25.66 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.878 1.271 . . . . 0.0 114.008 -174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -126.02 17.25 7.88 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.392 1.477 . . . . 0.0 113.955 -173.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.96 141.67 45.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.024 0.93 . . . . 0.0 110.977 173.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.7 t -90.78 128.73 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.137 1.375 . . . . 0.0 107.654 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -102.98 111.42 65.02 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.298 1.039 . . . . 0.0 110.624 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.02 143.03 48.34 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 123.057 2.505 . . . . 0.0 110.433 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.2 p -92.33 161.68 14.58 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.583 1.153 . . . . 0.0 113.899 -173.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.7 177.35 48.13 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.904 1.24 . . . . 0.0 114.06 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -143.17 168.99 18.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.92 2.088 . . . . 0.0 110.259 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -145.11 -179.71 6.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.668 0.787 . . . . 0.0 112.185 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -126.81 130.67 50.72 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.735 1.214 . . . . 0.0 110.558 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -159.2 138.05 11.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.78 1.632 . . . . 0.0 110.417 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 53.42 29.02 8.2 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.571 1.148 . . . . 0.0 112.903 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 70.07 16.55 7.49 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.955 2.102 . . . . 0.0 114.273 -177.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.9 mt -115.94 155.57 27.76 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.189 1.795 . . . . 0.0 110.454 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -88.6 129.3 35.52 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -107.6 146.08 32.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.828 1.651 . . . . 0.0 113.2 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.46 137.49 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.213 1.405 . . . . 0.0 109.507 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -76.99 148.19 36.41 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.331 1.052 . . . . 0.0 112.911 177.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 49.0 mmm -87.19 149.64 24.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.563 0.745 . . . . 0.0 112.228 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 12.6 m -79.12 161.07 26.73 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.393 0.677 . . . . 0.0 111.674 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -31.66 -50.01 0.18 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 118.923 2.934 . . . . 0.0 118.923 -168.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -74.35 -13.27 60.72 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.413 1.46 . . . . 0.0 113.771 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 mt -120.43 13.97 11.9 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.526 1.931 . . . . 0.0 110.534 169.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.95 -16.12 59.13 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 125.6 1.572 . . . . 0.0 116.707 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.9 m -143.11 155.44 44.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.425 1.89 . . . . 0.0 107.555 175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.08 -49.72 40.28 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.518 1.127 . . . . 0.0 112.527 -173.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -48.62 69.8 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.755 0.822 . . . . 0.0 112.13 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -56.3 -43.22 78.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.817 1.247 . . . . 0.0 113.054 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -40.16 72.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.23 -40.68 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 118.507 0.594 . . . . 0.0 110.413 172.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.34 -34.69 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.9 1.28 . . . . 0.0 112.859 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -69.38 -33.91 73.74 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.167 -0.958 . . . . 0.0 112.581 174.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.15 -26.91 22.21 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.66 1.184 . . . . 0.0 113.599 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -46.09 -44.57 37.17 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 127.731 2.412 . . . . 0.0 114.465 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -57.82 -26.22 72.78 Favored 'Trans proline' 0 CA--C 1.536 0.592 0 C-N-CA 124.019 3.146 . . . . 0.0 115.521 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.2 mm -111.59 -34.96 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.82 1.248 . . . . 0.0 112.863 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -119.14 143.31 47.27 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.499 1.52 . . . . 0.0 110.042 -172.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 80.8 p -64.0 153.05 38.45 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 173.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -52.63 -47.62 66.92 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.739 -0.6 . . . . 0.0 111.831 -175.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.6 m -61.94 -40.79 96.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.243 1.817 . . . . 0.0 112.954 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.81 -32.59 71.94 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.679 1.127 . . . . 0.0 112.748 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 46.9 mt -72.71 -46.87 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.703 0.801 . . . . 0.0 109.826 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -59.82 -39.35 84.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 175.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -61.92 -45.25 94.52 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.958 0.903 . . . . 0.0 112.362 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.28 65.18 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 118.882 0.765 . . . . 0.0 112.272 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -60.81 -42.71 98.2 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.112 1.456 . . . . 0.0 111.017 172.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -66.37 -44.64 82.6 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.369 -0.832 . . . . 0.0 112.581 172.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.32 -27.82 67.47 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -108.68 9.13 27.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.277 1.431 . . . . 0.0 112.934 177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.4 m-70 64.71 31.77 11.69 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.175 1.79 . . . . 0.0 113.369 169.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -56.36 129.93 42.56 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.726 1.611 . . . . 0.0 111.07 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -139.1 -179.9 6.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.573 1.149 . . . . 0.0 112.59 -169.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 81.3 t -134.83 138.68 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.255 1.822 . . . . 0.0 109.624 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.3 t -144.59 131.7 20.51 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.369 1.067 . . . . 0.0 110.083 170.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 59.3 18.45 6.68 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.221 1.409 . . . . 0.0 113.737 -174.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.53 -4.88 85.15 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 126.178 1.847 . . . . 0.0 114.452 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -90.33 134.29 34.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.637 1.218 . . . . 0.0 110.657 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.446 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.9 tt -64.78 143.22 58.08 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.446 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.55 152.22 43.91 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.909 0.884 . . . . 0.0 112.688 171.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.3 m -131.53 149.84 74.67 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 125.795 1.638 . . . . 0.0 110.149 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.62 148.39 32.87 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.529 2.153 . . . . 0.0 111.715 -177.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.43 132.46 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.469 1.107 . . . . 0.0 110.528 174.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -148.84 -143.79 3.84 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.854 1.693 . . . . 0.0 112.079 173.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -149.66 136.42 19.42 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.665 1.586 . . . . 0.0 110.635 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -110.29 -168.33 19.59 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.621 1.105 . . . . 0.0 115.192 -169.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.1 t0 70.85 171.12 0.32 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.911 2.484 . . . . 0.0 112.487 -173.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -145.72 146.91 31.43 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.616 1.167 . . . . 0.0 111.754 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.15 -22.52 66.92 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.395 1.078 . . . . 0.0 112.223 171.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.463 ' HB3' HG11 ' A' ' 128' ' ' VAL . 33.2 mt -59.19 121.49 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.808 1.643 . . . . 0.0 111.703 171.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -98.67 87.43 3.79 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.243 1.417 . . . . 0.0 110.736 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -73.49 -25.58 60.52 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.488 0.715 . . . . 0.0 112.482 -173.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.39 -17.48 62.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.638 1.175 . . . . 0.0 113.646 173.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.32 -0.62 16.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.785 1.634 . . . . 0.0 113.171 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 p -71.52 166.49 21.68 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.618 0.969 . . . . 0.0 113.618 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.2 p -136.89 141.55 42.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.185 1.394 . . . . 0.0 110.617 176.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.12 141.49 30.19 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.052 1.341 . . . . 0.0 112.346 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.91 123.09 21.67 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.878 2.071 . . . . 0.0 109.29 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 42.1 tp -63.69 134.49 55.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.511 1.124 . . . . 0.0 111.576 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.3 mm -116.76 -36.77 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.878 1.271 . . . . 0.0 112.175 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.0 t -158.28 142.67 15.97 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.67 0.788 . . . . 0.0 110.663 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.3 ttmt -142.85 97.32 3.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.963 1.305 . . . . 0.0 108.826 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -135.77 92.55 2.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.732 1.213 . . . . 0.0 111.892 -168.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.59 -122.03 27.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.989 0.804 . . . . 0.0 111.459 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.7 m -80.31 7.0 10.46 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.5 m -130.13 136.15 48.98 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.064 1.746 . . . . 0.0 110.867 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.8 mt -140.13 140.43 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.572 1.549 . . . . 0.0 109.553 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.3 m -122.18 137.12 54.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.685 1.194 . . . . 0.0 111.584 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -123.96 147.34 47.83 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.683 1.993 . . . . 0.0 111.843 172.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -101.2 128.68 47.2 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 125.114 1.366 . . . . 0.0 107.854 168.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -100.5 124.16 45.67 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.722 1.609 . . . . 0.0 109.735 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.3 m -95.64 108.68 20.98 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.1 t -111.31 105.23 56.86 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 123.606 0.762 . . . . 0.0 110.379 -169.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.35 159.6 43.08 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.354 2.702 . . . . 0.0 111.183 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -112.29 148.0 35.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.566 0.698 . . . . 0.0 112.383 -174.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.91 -11.49 60.14 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.27 1.428 . . . . 0.0 112.481 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.95 -21.8 50.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.765 1.626 . . . . 0.0 112.784 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.71 76.09 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.762 1.172 . . . . 0.0 113.809 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.7 m -75.66 157.32 84.25 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.563 1.145 . . . . 0.0 112.045 171.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -53.68 146.92 42.07 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.262 3.308 . . . . 0.0 113.566 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.8 m -61.43 131.14 49.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.537 1.135 . . . . 0.0 114.041 -173.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.87 140.71 32.73 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.333 1.453 . . . . 0.0 111.956 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -88.99 136.65 32.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.051 0.94 . . . . 0.0 112.875 170.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -136.54 120.7 17.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.733 2.013 . . . . 0.0 109.874 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -88.43 125.4 34.71 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.264 -0.897 . . . . 0.0 109.947 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.0 t -124.86 117.32 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.702 1.601 . . . . 0.0 109.017 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -106.82 130.47 54.51 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.839 1.256 . . . . 0.0 109.587 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -112.71 137.32 51.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 126.651 1.98 . . . . 0.0 108.776 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 83.3 t -129.25 126.33 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 125.708 1.603 . . . . 0.0 108.018 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -79.2 110.43 14.46 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 122.027 -0.42 . . . . 0.0 110.357 174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -83.28 -22.46 32.99 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -171.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -161.53 -68.36 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.305 1.442 . . . . 0.0 110.802 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.63 6.23 3.47 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.411 1.484 . . . . 0.0 113.115 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -145.81 137.67 25.21 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.249 1.819 . . . . 0.0 113.129 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -77.46 122.35 25.08 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.45 1.9 . . . . 0.0 111.716 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -127.0 150.53 49.39 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.51 1.524 . . . . 0.0 112.14 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.5 t -73.7 132.72 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.118 0.967 . . . . 0.0 110.32 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -81.67 7.94 11.12 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -154.76 131.75 10.89 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.162 1.385 . . . . 0.0 109.994 -175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -68.42 -47.49 67.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.595 0.758 . . . . 0.0 112.981 -175.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.43 13.59 8.05 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.204 1.402 . . . . 0.0 113.444 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.21 66.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 113.178 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 57.7 t -144.69 113.81 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 126.238 1.815 . . . . 0.0 109.551 -174.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 17.6 pt . . . . . 0 C--O 1.25 1.13 0 C-N-CA 124.938 1.295 . . . . 0.0 113.595 -174.21 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.675 -0.57 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -139.51 155.91 47.25 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.902 1.681 . . . . 0.0 111.648 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -145.86 165.46 28.83 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.805 1.642 . . . . 0.0 111.655 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -155.6 164.44 38.64 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.023 1.729 . . . . 0.0 110.686 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.5 p -168.37 -179.61 4.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.846 1.658 . . . . 0.0 112.064 -169.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.78 -53.84 4.89 Favored Glycine 0 N--CA 1.471 1.009 0 C-N-CA 125.195 1.379 . . . . 0.0 112.661 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.08 175.93 6.68 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.343 1.457 . . . . 0.0 111.683 173.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 tt -116.8 127.95 54.82 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.804 1.642 . . . . 0.0 110.735 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.4 p -101.42 172.59 6.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.053 2.141 . . . . 0.0 114.189 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -57.68 -41.27 81.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.01 -1.056 . . . . 0.0 111.772 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -67.29 -47.46 70.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.575 0.75 . . . . 0.0 111.762 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -55.5 -54.31 45.5 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.122 0.969 . . . . 0.0 110.602 174.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -47.35 78.94 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.804 0.842 . . . . 0.0 111.825 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.65 -45.51 81.57 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.901 1.28 . . . . 0.0 111.915 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -73.48 -41.53 63.02 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.274 -0.891 . . . . 0.0 111.989 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.2 mt -55.18 -40.88 71.22 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.036 0.934 . . . . 0.0 110.675 171.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.09 -49.56 69.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.268 1.027 . . . . 0.0 111.817 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.16 -45.18 87.92 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.457 0.703 . . . . 0.0 112.121 175.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 t -67.05 -36.68 82.57 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 122.126 -0.359 . . . . 0.0 111.68 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.98 -42.09 90.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.951 -1.093 . . . . 0.0 112.508 176.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -41.37 97.58 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.404 0.682 . . . . 0.0 111.286 173.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -61.75 -49.02 78.09 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.775 0.83 . . . . 0.0 111.714 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -64.55 -37.14 86.54 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.048 -1.033 . . . . 0.0 113.277 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 159' ' ' ILE . 53.6 t80 -65.84 -57.82 7.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.012 0.925 . . . . 0.0 111.424 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -62.02 -29.55 70.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -64.13 -56.99 10.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.266 0.626 . . . . 0.0 111.268 169.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 38.7 m -60.31 -43.56 96.22 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.962 0.905 . . . . 0.0 111.922 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.2 mmm -64.9 -9.3 20.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -93.46 -1.67 55.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.863 1.265 . . . . 0.0 113.296 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.68 -2.3 76.72 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.131 1.348 . . . . 0.0 115.225 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -159.95 145.1 15.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.704 1.202 . . . . 0.0 113.098 -171.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.408 ' HA ' ' HD2' ' A' ' 33' ' ' PRO . 25.0 p-10 -95.35 103.6 12.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.823 1.249 . . . . 0.0 111.741 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 32' ' ' ASN . 55.9 Cg_endo -61.14 -9.06 11.38 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 124.28 3.32 . . . . 0.0 114.247 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -58.51 -24.13 59.77 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.704 0.801 . . . . 0.0 111.939 167.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.1 t -101.53 116.71 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 126.589 1.956 . . . . 0.0 107.91 171.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.47 -16.73 47.75 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -142.66 114.98 8.42 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.051 1.74 . . . . 0.0 110.425 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.9 45.06 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.864 1.666 . . . . 0.0 109.593 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 73.1 t -77.66 128.81 38.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.45 131.2 6.83 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.698 -0.667 . . . . 0.0 112.648 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.73 153.22 19.91 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.653 2.902 . . . . 0.0 111.525 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.4 m -88.31 -0.82 57.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -93.2 164.67 27.31 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.634 1.588 . . . . 0.0 114.407 -174.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.2 p -143.06 169.53 17.4 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.176 2.19 . . . . 0.0 110.122 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -146.63 -174.57 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 111.804 176.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -129.93 132.35 46.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.508 1.123 . . . . 0.0 110.947 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -155.99 135.16 12.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.93 1.692 . . . . 0.0 110.477 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 55.64 29.27 13.35 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.823 1.249 . . . . 0.0 112.825 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.79 18.24 7.48 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.396 1.878 . . . . 0.0 113.626 -177.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -115.26 151.76 33.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.061 1.744 . . . . 0.0 110.112 175.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -84.34 128.34 34.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 168.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -105.97 142.06 36.32 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 0.0 112.808 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 15.6 m -114.27 133.2 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 125.209 1.404 . . . . 0.0 109.548 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -71.39 141.16 50.35 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.767 1.227 . . . . 0.0 112.049 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 mmm -79.64 150.33 31.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.367 0.667 . . . . 0.0 111.511 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 39.6 m -71.17 158.82 35.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.714 -0.616 . . . . 0.0 111.509 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.4 p -47.51 -34.06 7.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -166.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -77.32 -11.32 59.82 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 121.043 1.747 . . . . 0.0 113.498 178.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.71 14.79 12.65 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.493 2.317 . . . . 0.0 110.22 169.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.6 -13.92 56.6 Favored Glycine 0 N--CA 1.472 1.07 0 N-CA-C 116.985 1.554 . . . . 0.0 116.985 -166.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 9.0 m -143.54 155.22 44.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.45 1.9 . . . . 0.0 107.526 175.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -49.07 -48.79 43.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.357 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.35 -49.28 70.15 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.745 0.818 . . . . 0.0 112.437 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -56.2 -41.92 76.34 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.497 1.119 . . . . 0.0 113.234 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 -39.86 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.38 -44.64 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.284 0.493 . . . . 0.0 109.683 170.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.25 -35.1 74.71 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.746 1.219 . . . . 0.0 113.428 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -69.93 -33.87 72.71 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.143 -0.973 . . . . 0.0 112.708 174.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -87.02 -29.57 21.86 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.63 1.172 . . . . 0.0 113.607 -176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.35 -44.79 28.93 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 128.237 2.615 . . . . 0.0 114.547 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.96 -25.37 69.76 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 124.005 3.137 . . . . 0.0 115.517 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.438 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -108.11 -39.8 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.781 1.233 . . . . 0.0 111.78 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -115.09 142.04 47.18 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.555 1.542 . . . . 0.0 110.836 -169.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 67.9 p -63.84 156.96 25.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.762 0.425 . . . . 0.0 109.909 172.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -46.73 -54.2 10.19 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.841 -0.537 . . . . 0.0 111.383 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.9 m -59.5 -40.67 87.81 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.226 1.41 . . . . 0.0 112.643 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -34.3 74.97 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.334 0.97 . . . . 0.0 112.435 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.2 mt -74.41 -46.6 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.841 0.856 . . . . 0.0 109.869 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -59.59 -40.68 88.22 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.116 0.416 . . . . 0.0 111.613 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.16 -47.39 86.42 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.939 0.896 . . . . 0.0 111.994 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.44 -34.34 68.24 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.873 0.76 . . . . 0.0 112.424 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -61.59 -42.32 98.69 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.955 1.378 . . . . 0.0 111.054 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -67.74 -45.21 75.66 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.256 -0.903 . . . . 0.0 112.656 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -68.89 -28.22 66.49 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -173.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.09 6.0 26.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.239 1.415 . . . . 0.0 112.798 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 66.73 33.35 6.31 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.768 2.027 . . . . 0.0 114.15 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -55.98 129.06 38.23 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.025 1.73 . . . . 0.0 110.397 174.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -140.47 178.69 7.14 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.351 1.06 . . . . 0.0 112.635 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.3 t -128.81 135.53 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 125.734 1.614 . . . . 0.0 109.461 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 44.8 t -141.92 126.15 17.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.127 1.371 . . . . 0.0 109.229 174.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 62.59 16.75 9.08 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.132 1.373 . . . . 0.0 113.712 -176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.53 -5.05 82.6 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.322 1.915 . . . . 0.0 114.353 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -93.91 138.2 32.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.981 1.313 . . . . 0.0 111.144 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.74 141.94 57.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.799 0.84 . . . . 0.0 108.779 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -142.32 154.56 44.79 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.138 0.975 . . . . 0.0 112.889 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.1 m -132.82 150.04 74.62 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 125.865 1.666 . . . . 0.0 110.218 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.46 146.57 39.75 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.521 2.147 . . . . 0.0 111.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -67.47 132.65 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.091 0.956 . . . . 0.0 110.338 173.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -153.33 -169.74 18.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.966 1.746 . . . . 0.0 112.324 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -156.81 139.57 15.14 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.107 1.363 . . . . 0.0 111.008 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.82 154.62 13.67 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 124.475 1.036 . . . . 0.0 113.509 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.91 130.31 1.2 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.963 2.105 . . . . 0.0 109.413 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -96.56 132.22 42.38 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.441 0.696 . . . . 0.0 111.747 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.26 -0.38 4.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.585 1.554 . . . . 0.0 114.3 170.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 48.8 mt -69.39 120.83 15.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.136 1.774 . . . . 0.0 110.62 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -94.19 84.14 4.38 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.504 1.122 . . . . 0.0 110.339 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -70.67 -23.83 62.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.177 0.591 . . . . 0.0 112.248 -175.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -66.99 -17.42 64.91 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.675 1.19 . . . . 0.0 113.552 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -109.96 -0.54 18.13 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.619 1.568 . . . . 0.0 112.952 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.16 165.81 22.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.187 0.995 . . . . 0.0 113.105 174.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -137.13 139.92 41.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.839 1.256 . . . . 0.0 110.773 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.81 152.55 18.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.485 1.114 . . . . 0.0 113.708 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -141.85 121.05 13.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 128.046 2.538 . . . . 0.0 109.85 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.53 128.28 35.27 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.32 0.964 . . . . 0.0 110.273 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.4 mm -102.26 -44.64 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.858 1.263 . . . . 0.0 111.552 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.5 t -163.21 152.68 15.09 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.416 0.627 . . . . 0.0 112.241 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -130.02 109.41 10.84 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.095 1.758 . . . . 0.0 108.887 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -126.41 76.34 1.61 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 110.201 -171.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 60.76 -116.22 8.95 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.968 0.794 . . . . 0.0 111.7 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.1 m -75.99 2.84 11.57 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 28.4 m -126.81 138.76 53.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.304 1.842 . . . . 0.0 110.364 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 88.9 mt -139.17 140.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.54 1.536 . . . . 0.0 109.561 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 53.9 m -118.44 135.26 54.46 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.073 0.949 . . . . 0.0 110.985 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -120.02 147.62 44.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.725 1.61 . . . . 0.0 111.919 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -101.64 149.19 24.38 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.2 1.8 . . . . 0.0 108.351 168.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -130.53 127.73 39.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.254 1.822 . . . . 0.0 109.955 -173.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 82.0 m -99.17 114.56 27.4 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 169.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.9 t -116.19 105.48 50.74 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 123.662 0.785 . . . . 0.0 110.375 -169.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -65.88 161.51 39.06 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.422 2.748 . . . . 0.0 111.367 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.7 p -109.05 153.11 24.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.39 0.676 . . . . 0.0 112.46 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 98.2 mt -79.86 -5.81 56.2 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.062 1.345 . . . . 0.0 113.079 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -99.16 -7.25 26.87 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.27 1.428 . . . . 0.0 113.203 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.92 7.0 71.32 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.02 1.295 . . . . 0.0 114.394 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 73.8 m -75.6 155.64 85.31 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.819 1.248 . . . . 0.0 112.205 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -54.13 147.38 44.57 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.113 3.209 . . . . 0.0 113.288 175.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -61.49 132.04 52.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.403 1.081 . . . . 0.0 113.89 -175.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.18 141.09 36.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.006 1.322 . . . . 0.0 111.38 177.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 135.02 38.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.124 0.97 . . . . 0.0 111.435 172.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.11 151.52 47.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.083 2.153 . . . . 0.0 110.29 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.73 134.96 52.64 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.413 1.085 . . . . 0.0 111.172 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.8 t -135.85 123.45 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.669 1.587 . . . . 0.0 109.2 -171.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 87.4 m -108.64 134.34 51.51 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.827 1.251 . . . . 0.0 109.679 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -118.06 139.25 51.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.518 1.927 . . . . 0.0 109.11 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 98.6 t -131.19 127.44 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.761 1.624 . . . . 0.0 108.256 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -80.77 111.95 17.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.115 0.566 . . . . 0.0 110.771 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -95.49 -39.87 9.75 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -158.96 89.6 0.94 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.852 1.261 . . . . 0.0 109.947 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.3 mttp 63.35 3.66 1.46 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.617 1.567 . . . . 0.0 113.861 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -146.94 133.81 20.15 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.292 1.837 . . . . 0.0 111.678 -168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -81.32 127.26 32.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.534 1.934 . . . . 0.0 112.252 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -131.06 153.47 49.27 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.507 1.523 . . . . 0.0 112.336 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.76 132.98 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 125.447 1.499 . . . . 0.0 110.254 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -83.42 5.59 23.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -155.65 129.59 8.65 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.602 1.161 . . . . 0.0 110.914 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.11 -42.98 99.53 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.701 1.2 . . . . 0.0 113.689 -174.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -98.35 19.29 14.6 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.336 1.854 . . . . 0.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.58 -27.01 65.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 113.135 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 22.0 t -144.65 127.42 10.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 C-N-CA 126.691 1.997 . . . . 0.0 108.069 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.417 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.571 1.548 . . . . 0.0 111.987 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -157.18 151.3 24.82 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.327 1.451 . . . . 0.0 111.682 -177.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -145.63 160.93 40.96 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.178 1.791 . . . . 0.0 110.564 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.9 t -165.36 163.83 19.82 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.74 1.616 . . . . 0.0 111.359 -175.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -102.8 -7.54 21.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.451 1.5 . . . . 0.0 112.646 169.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -69.31 -21.96 76.07 Favored Glycine 0 N--CA 1.474 1.194 0 C-N-CA 124.643 1.116 . . . . 0.0 113.659 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -158.03 163.25 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.535 2.334 . . . . 0.0 110.116 169.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 tt -104.79 132.17 51.35 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.306 1.443 . . . . 0.0 111.395 -168.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -106.91 165.06 11.62 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 127.041 2.137 . . . . 0.0 113.695 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -51.67 -44.5 63.08 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.739 1.216 . . . . 0.0 113.581 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.04 -47.38 83.27 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.587 0.755 . . . . 0.0 112.236 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -57.39 -53.4 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.771 1.228 . . . . 0.0 110.21 176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -46.63 79.02 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.273 0.629 . . . . 0.0 111.893 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.37 -44.25 95.78 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.802 1.241 . . . . 0.0 111.788 178.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -70.83 -41.88 70.92 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.066 -1.021 . . . . 0.0 111.682 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.71 -40.77 72.89 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.815 0.846 . . . . 0.0 110.995 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.79 -49.72 69.57 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.318 1.047 . . . . 0.0 111.803 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -58.95 -43.67 91.3 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.513 0.725 . . . . 0.0 112.051 176.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.4 t -64.39 -42.3 96.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.709 0.404 . . . . 0.0 111.704 177.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.84 -38.63 91.55 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.168 -0.957 . . . . 0.0 112.751 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -43.4 94.25 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.436 0.562 . . . . 0.0 111.861 173.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.71 -47.23 87.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.065 0.546 . . . . 0.0 111.598 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -63.38 -45.67 90.01 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.843 0.857 . . . . 0.0 112.671 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE1' HG21 ' A' ' 159' ' ' ILE . 62.8 t80 -61.15 -56.89 15.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.007 0.923 . . . . 0.0 111.416 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 17.4 m95 -59.51 -38.54 81.2 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.68 -27.36 55.54 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 88.5 m -69.13 -45.08 71.03 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 110.639 171.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.1 mmm -61.52 -27.52 68.66 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.292 1.037 . . . . 0.0 113.114 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.8 m -80.91 -6.65 58.93 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.898 1.279 . . . . 0.0 113.842 172.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.408 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 83.49 12.51 78.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.783 1.659 . . . . 0.0 116.125 172.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -164.09 129.1 2.83 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 -169.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.3 t30 -79.38 112.77 31.22 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.339 1.456 . . . . 0.0 111.471 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.72 -14.35 42.33 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.274 3.316 . . . . 0.0 114.345 -175.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -69.52 -19.4 63.71 Favored 'General case' 0 CA--C 1.543 0.712 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 172.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -98.26 122.73 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -106.36 -4.41 20.01 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -137.52 24.72 2.91 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.035 1.734 . . . . 0.0 113.147 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.21 140.81 57.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.177 0.991 . . . . 0.0 111.666 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.61 128.83 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 171.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -148.96 117.58 3.91 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.504 -169.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.79 139.02 86.42 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.496 2.797 . . . . 0.0 112.662 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -87.62 -3.26 58.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.419 1.088 . . . . 0.0 113.334 172.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.36 166.03 33.01 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.932 1.729 . . . . 0.0 113.571 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.2 p -143.02 169.82 16.86 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.61 1.964 . . . . 0.0 110.524 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -145.65 177.87 8.57 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.997 0.919 . . . . 0.0 112.005 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.68 131.44 53.61 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.726 1.211 . . . . 0.0 110.669 -177.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -158.41 136.74 10.88 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.982 1.713 . . . . 0.0 110.253 -175.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 56.26 27.31 11.58 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 124.663 1.185 . . . . 0.0 112.975 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.23 20.03 7.65 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.296 1.839 . . . . 0.0 113.522 -176.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.9 mt -118.6 156.92 28.35 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.223 1.809 . . . . 0.0 110.146 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -90.77 129.92 36.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 168.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -107.8 143.77 35.9 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.867 1.667 . . . . 0.0 112.597 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -116.34 136.24 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.967 1.307 . . . . 0.0 109.323 175.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -70.39 140.07 52.03 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.388 0.675 . . . . 0.0 111.71 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.408 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.8 mmm -70.58 150.76 45.74 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.301 0.64 . . . . 0.0 111.238 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 57.0 m -71.03 157.2 38.62 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.876 -0.515 . . . . 0.0 110.286 169.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.1 p -55.32 -20.55 11.85 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -167.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.24 -20.86 63.95 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.74 2.016 . . . . 0.0 114.26 171.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.4 mt -129.32 21.64 5.66 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.615 2.366 . . . . 0.0 109.957 172.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.83 -15.23 59.77 Favored Glycine 0 N--CA 1.475 1.252 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -167.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.5 m -143.65 154.62 43.71 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.458 1.903 . . . . 0.0 108.064 -179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -47.17 -49.45 22.54 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.066 0.946 . . . . 0.0 112.415 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.7 52.83 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.993 0.917 . . . . 0.0 111.892 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -53.17 -39.68 63.78 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.222 1.009 . . . . 0.0 113.482 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.53 60.4 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.7 t -60.68 -41.42 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.423 0.556 . . . . 0.0 110.509 172.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -61.36 -38.85 88.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.319 1.448 . . . . 0.0 112.595 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -66.61 -35.28 79.81 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.447 -0.783 . . . . 0.0 112.809 175.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -87.15 -27.85 22.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.605 1.162 . . . . 0.0 113.567 -176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -46.44 -45.57 44.9 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 127.495 2.318 . . . . 0.0 114.154 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -57.89 -25.19 68.38 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.896 3.064 . . . . 0.0 115.477 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.9 mm -111.71 -32.85 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.146 1.378 . . . . 0.0 112.771 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.06 140.73 52.69 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 125.679 1.592 . . . . 0.0 110.415 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.2 p -63.32 154.5 31.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.001 0.52 . . . . 0.0 109.721 173.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.75 -47.24 64.17 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.5 -0.75 . . . . 0.0 111.09 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 79.6 m -60.27 -42.43 95.39 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.98 1.312 . . . . 0.0 112.472 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.01 -35.29 76.45 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.487 1.039 . . . . 0.0 112.219 176.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.2 mt -72.38 -49.32 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.865 0.866 . . . . 0.0 110.093 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -59.07 -41.66 88.49 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 118.228 0.467 . . . . 0.0 111.639 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.61 -46.21 91.12 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.071 0.949 . . . . 0.0 112.211 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.03 -32.96 65.58 Favored Glycine 0 CA--C 1.531 1.056 0 CA-C-N 118.742 0.701 . . . . 0.0 112.518 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -63.14 -41.01 99.22 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.19 1.495 . . . . 0.0 110.838 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -69.89 -44.09 70.44 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.231 -0.918 . . . . 0.0 112.726 173.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.39 -29.93 68.74 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -174.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.56 6.39 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.002 1.321 . . . . 0.0 112.769 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 67.4 28.57 7.74 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.629 1.971 . . . . 0.0 113.9 169.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -51.7 127.47 20.72 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.407 1.483 . . . . 0.0 109.737 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.9 t -134.91 178.9 6.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.673 1.189 . . . . 0.0 111.826 -168.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -137.7 135.06 46.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 125.73 1.612 . . . . 0.0 108.869 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 t -141.57 128.49 20.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.338 1.055 . . . . 0.0 110.008 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp 58.77 21.18 8.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.323 1.449 . . . . 0.0 113.667 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 -5.55 84.53 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 126.159 1.837 . . . . 0.0 114.526 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -92.29 134.33 35.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.931 1.292 . . . . 0.0 110.768 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.37 142.29 56.8 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.147 0.979 . . . . 0.0 109.274 173.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 154.99 46.51 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.075 0.95 . . . . 0.0 113.125 172.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 33.2 m -134.82 148.88 68.94 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 125.847 1.659 . . . . 0.0 110.504 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.92 146.01 41.27 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 122.557 2.171 . . . . 0.0 111.112 -177.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.4 mt -66.43 133.76 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.057 0.943 . . . . 0.0 110.606 175.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -171.77 -172.14 37.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.266 1.889 . . . . 0.0 111.995 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -158.42 152.22 23.59 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.184 1.394 . . . . 0.0 111.578 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.75 152.65 22.1 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.381 0.991 . . . . 0.0 113.113 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -166.36 132.05 2.36 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.587 1.955 . . . . 0.0 109.405 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -109.36 140.21 43.35 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.247 1.019 . . . . 0.0 111.559 -176.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.26 -16.78 64.3 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.048 1.339 . . . . 0.0 112.992 172.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.402 ' HB3' HG11 ' A' ' 128' ' ' VAL . 46.5 mt -56.43 117.44 3.84 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.831 2.052 . . . . 0.0 112.1 176.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -97.05 87.66 4.28 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.973 1.309 . . . . 0.0 110.295 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -72.14 -24.69 61.49 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.266 0.626 . . . . 0.0 112.311 -174.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -66.95 -17.4 64.9 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.527 1.131 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -108.72 -0.24 20.15 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.382 1.473 . . . . 0.0 112.961 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.3 p -71.01 164.3 25.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.776 0.831 . . . . 0.0 113.217 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.3 p -135.14 138.64 43.92 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.787 1.235 . . . . 0.0 110.791 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.55 148.63 22.15 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.33 1.052 . . . . 0.0 113.553 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -138.35 121.64 17.03 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 128.521 2.728 . . . . 0.0 108.936 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -69.15 129.87 41.08 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.344 -0.847 . . . . 0.0 110.906 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -106.06 -40.4 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.316 1.446 . . . . 0.0 111.957 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.1 t -161.05 142.04 11.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.54 0.736 . . . . 0.0 111.001 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -140.15 97.34 3.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.052 1.341 . . . . 0.0 109.176 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -135.27 92.29 2.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.848 1.259 . . . . 0.0 112.065 -168.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.6 -121.83 27.2 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 123.86 0.743 . . . . 0.0 111.31 176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.5 m -82.2 6.74 15.65 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.6 m -129.32 135.35 48.63 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.027 1.731 . . . . 0.0 110.648 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 84.1 mt -141.5 139.66 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.41 1.484 . . . . 0.0 109.414 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 56.9 m -122.05 134.12 54.79 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.362 1.065 . . . . 0.0 111.208 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -120.79 146.51 46.44 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.783 1.633 . . . . 0.0 111.769 170.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.9 144.99 29.84 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.724 1.61 . . . . 0.0 108.057 168.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -122.35 124.23 43.21 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.834 1.653 . . . . 0.0 109.624 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 76.8 m -90.53 108.13 19.6 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 169.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.25 105.92 57.58 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.582 0.753 . . . . 0.0 110.189 -171.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -66.05 160.15 45.92 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 123.419 2.746 . . . . 0.0 111.455 175.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.5 p -108.89 150.82 27.13 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.576 0.75 . . . . 0.0 112.105 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.2 mt -76.23 -7.6 55.22 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.929 1.292 . . . . 0.0 113.332 174.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -99.64 -7.17 26.08 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.153 1.381 . . . . 0.0 113.206 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.48 8.07 71.34 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.84 1.209 . . . . 0.0 114.548 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 75.1 m -72.33 154.91 91.85 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.686 1.194 . . . . 0.0 112.045 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.42 142.97 56.68 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 124.178 3.252 . . . . 0.0 113.418 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 131.39 49.86 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.588 1.155 . . . . 0.0 113.766 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.51 132.87 35.74 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.84 1.256 . . . . 0.0 111.049 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.58 128.71 37.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.266 1.026 . . . . 0.0 111.257 172.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -138.66 127.8 24.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.917 1.687 . . . . 0.0 111.666 -173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -99.83 131.47 45.78 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.539 1.135 . . . . 0.0 111.448 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 40.5 t -132.01 122.38 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.425 1.89 . . . . 0.0 109.035 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 88.9 m -107.84 131.31 54.62 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.762 1.225 . . . . 0.0 109.676 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -113.1 137.17 51.84 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.833 2.053 . . . . 0.0 108.897 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 93.0 t -131.06 126.64 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.767 1.627 . . . . 0.0 107.919 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -80.43 115.15 19.81 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.923 -0.486 . . . . 0.0 110.948 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.24 -44.26 6.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.53 0.732 . . . . 0.0 112.46 -173.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -161.51 92.29 0.88 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.082 1.353 . . . . 0.0 109.836 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 62.92 3.58 1.25 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.253 1.421 . . . . 0.0 114.178 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -141.2 129.25 22.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.127 1.771 . . . . 0.0 111.552 -174.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.91 120.37 20.35 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.452 1.501 . . . . 0.0 110.662 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -126.28 150.91 48.14 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.249 1.42 . . . . 0.0 112.035 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -72.53 132.65 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 125.047 1.339 . . . . 0.0 110.145 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -82.05 7.01 14.42 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -154.78 130.29 9.85 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.997 1.319 . . . . 0.0 110.347 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.81 -41.26 95.93 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.486 1.114 . . . . 0.0 113.727 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -99.96 19.14 16.76 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.499 1.92 . . . . 0.0 112.994 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.62 -25.92 65.05 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.175 0.99 . . . . 0.0 113.549 -175.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.1 t -144.87 126.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 126.719 2.008 . . . . 0.0 108.034 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.131 1.372 . . . . 0.0 112.421 -175.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.181 -0.367 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -147.59 8.78 0.9 Allowed 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.78 162.93 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.835 1.654 . . . . 0.0 112.197 -174.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 97.8 m -79.52 143.44 34.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.48 1.112 . . . . 0.0 109.243 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.3 p -160.51 155.39 24.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.451 1.5 . . . . 0.0 110.693 175.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 77.31 -43.81 2.09 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 125.047 1.308 . . . . 0.0 113.406 -176.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -95.02 161.36 14.17 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.389 1.876 . . . . 0.0 111.804 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -90.08 135.22 33.79 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.277 1.431 . . . . 0.0 110.836 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.6 t -121.2 166.49 13.9 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.209 1.803 . . . . 0.0 112.253 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -52.46 -44.28 65.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 0.0 113.422 -172.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.78 -46.2 90.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.486 0.715 . . . . 0.0 112.019 177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.12 -48.21 79.49 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.63 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.71 -47.78 76.27 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.419 1.009 . . . . 0.0 111.872 176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.4 -45.56 84.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.944 1.298 . . . . 0.0 111.765 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -71.42 -41.97 68.86 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.213 -0.929 . . . . 0.0 111.983 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -55.54 -40.71 72.23 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.994 0.918 . . . . 0.0 110.842 171.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.75 -48.27 75.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.378 1.071 . . . . 0.0 111.996 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.02 -40.83 97.2 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.48 0.712 . . . . 0.0 112.296 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -67.43 -34.49 77.33 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.769 -0.582 . . . . 0.0 111.572 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.75 -36.71 78.71 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.862 -1.149 . . . . 0.0 112.193 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 -54.92 -50.48 68.71 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.187 0.995 . . . . 0.0 110.379 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.94 -54.68 43.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.044 1.337 . . . . 0.0 111.211 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -67.63 -26.8 66.41 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.31 -60.34 2.33 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.595 0.634 . . . . 0.0 110.372 169.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -60.62 -38.5 84.96 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -173.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.74 -37.62 67.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.5 m -62.14 -43.54 98.61 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.507 1.049 . . . . 0.0 111.242 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mmm -64.06 -10.66 23.43 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 172.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 t -93.48 -5.7 48.56 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.167 1.387 . . . . 0.0 113.11 173.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.47 3.26 63.06 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.514 1.531 . . . . 0.0 115.537 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -155.66 145.82 21.63 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -98.39 106.53 36.49 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.906 1.282 . . . . 0.0 112.338 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.44 -9.38 17.71 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.388 3.392 . . . . 0.0 114.239 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -60.78 -24.24 65.63 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.832 0.742 . . . . 0.0 112.128 168.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.6 t -100.47 118.99 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 126.433 1.893 . . . . 0.0 108.191 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.62 -11.92 56.67 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -172.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -153.89 118.19 4.85 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.444 1.897 . . . . 0.0 110.031 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.94 152.52 50.28 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.177 1.791 . . . . 0.0 109.64 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.6 111.31 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 60.4 m -110.28 110.45 58.25 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.341 1.456 . . . . 0.0 110.025 -176.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.4 136.43 59.29 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 111.645 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.8 p -86.9 -2.73 58.82 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.24 159.74 32.71 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.481 1.515 . . . . 0.0 113.303 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 52.5 p -140.93 166.2 25.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.568 1.947 . . . . 0.0 110.049 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -147.51 176.79 9.77 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.842 0.857 . . . . 0.0 112.086 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -122.35 131.1 53.73 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.6 1.16 . . . . 0.0 110.766 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -158.64 136.4 10.36 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.829 1.652 . . . . 0.0 110.592 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 54.29 28.13 8.88 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 124.732 1.213 . . . . 0.0 112.948 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.7 18.95 8.65 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.23 1.812 . . . . 0.0 113.72 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.2 mt -115.22 155.54 27.01 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.238 1.815 . . . . 0.0 110.094 174.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -90.68 129.35 36.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 168.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -106.81 146.6 30.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.006 1.722 . . . . 0.0 112.638 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 32.4 m -122.6 138.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.021 1.329 . . . . 0.0 109.367 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -74.62 143.07 44.51 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.558 0.743 . . . . 0.0 112.219 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.2 mmm -74.81 153.41 38.75 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.641 0.776 . . . . 0.0 111.441 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.86 155.23 39.84 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.624 -0.673 . . . . 0.0 111.398 170.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 p -48.15 -34.11 9.41 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 118.335 2.717 . . . . 0.0 118.335 -167.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -79.23 -8.99 59.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.765 1.62 . . . . 0.0 113.633 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.8 mt -118.09 15.37 14.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.436 2.294 . . . . 0.0 109.742 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -11.8 54.86 Favored Glycine 0 N--CA 1.472 1.045 0 C-N-CA 125.614 1.578 . . . . 0.0 117.04 -166.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.3 m -144.21 155.1 43.74 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.202 1.801 . . . . 0.0 107.638 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -51.21 -47.08 62.37 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.225 1.01 . . . . 0.0 112.343 -172.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.62 71.63 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.711 0.804 . . . . 0.0 112.387 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -54.47 -41.58 69.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.644 1.178 . . . . 0.0 113.106 176.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.84 64.63 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 80.6 t -58.8 -42.01 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.54 0.609 . . . . 0.0 110.512 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.08 -32.88 73.47 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.749 1.22 . . . . 0.0 112.914 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.16 -32.66 61.36 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.004 0.921 . . . . 0.0 113.07 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.8 mt -86.0 -28.73 24.01 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.441 1.096 . . . . 0.0 113.341 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.34 -43.62 23.87 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 128.154 2.582 . . . . 0.0 114.581 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.62 -25.48 75.14 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 124.193 3.262 . . . . 0.0 115.747 176.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.29 -40.49 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.856 1.262 . . . . 0.0 111.976 -178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -113.77 142.72 45.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.456 1.503 . . . . 0.0 110.511 -170.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.6 p -65.54 153.83 40.36 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 172.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -50.44 -49.14 55.8 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.07 0.548 . . . . 0.0 112.089 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.0 m -63.11 -40.16 96.82 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.048 1.739 . . . . 0.0 113.059 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.97 71.68 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.39 0.995 . . . . 0.0 112.419 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.07 -47.08 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.784 0.834 . . . . 0.0 110.12 177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.97 -39.48 85.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.1 0.409 . . . . 0.0 111.738 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -62.13 -45.66 92.49 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.727 0.811 . . . . 0.0 112.38 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.65 -32.1 64.62 Favored Glycine 0 CA--C 1.531 1.073 0 CA-C-N 118.747 0.703 . . . . 0.0 112.496 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.76 -41.94 98.34 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.061 1.43 . . . . 0.0 111.055 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.61 -44.57 77.74 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.351 -0.843 . . . . 0.0 112.577 172.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.84 -28.69 66.96 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.25 6.4 26.57 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.302 1.441 . . . . 0.0 112.855 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.2 m-70 68.03 31.31 5.56 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.797 2.039 . . . . 0.0 114.23 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -53.72 120.86 6.78 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.718 1.607 . . . . 0.0 110.292 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -132.39 178.56 6.73 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.601 1.161 . . . . 0.0 112.355 -168.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.4 t -137.01 134.25 47.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 125.908 1.683 . . . . 0.0 109.457 -176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.7 t -143.54 127.54 17.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.285 1.034 . . . . 0.0 110.101 172.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? 58.67 22.34 9.81 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 125.282 1.433 . . . . 0.0 113.108 -173.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.41 -5.25 84.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.798 . . . . 0.0 114.535 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -89.46 133.65 34.46 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.893 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -67.47 139.6 57.05 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.179 0.992 . . . . 0.0 108.775 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -138.43 154.11 48.87 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.062 0.945 . . . . 0.0 112.977 171.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.4 m -134.94 150.16 72.45 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.966 1.706 . . . . 0.0 110.122 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.96 146.89 37.97 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.671 2.247 . . . . 0.0 111.392 -177.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.7 mt -64.12 133.75 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.254 1.022 . . . . 0.0 110.619 174.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.56 -175.8 43.28 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.001 1.762 . . . . 0.0 112.374 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -160.43 156.38 25.97 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.575 1.55 . . . . 0.0 111.295 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.28 156.18 27.85 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.245 0.926 . . . . 0.0 113.412 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -167.99 149.0 5.14 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.203 2.201 . . . . 0.0 109.706 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -135.22 142.05 45.94 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.573 1.149 . . . . 0.0 111.625 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -2.76 8.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.712 1.205 . . . . 0.0 114.032 169.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.415 ' HB3' HG11 ' A' ' 128' ' ' VAL . 62.9 mt -70.53 117.93 12.68 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.983 1.713 . . . . 0.0 110.673 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -95.89 78.04 3.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.908 1.283 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.8 m95 -67.02 -26.94 67.03 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.539 0.736 . . . . 0.0 112.171 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.02 -18.15 56.15 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.149 1.38 . . . . 0.0 113.753 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -113.46 0.71 14.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.922 1.689 . . . . 0.0 112.943 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.0 p -70.11 165.04 22.82 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.806 0.843 . . . . 0.0 113.063 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.9 p -133.06 141.92 48.49 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.016 1.327 . . . . 0.0 110.455 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.4 149.86 21.24 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 113.189 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -140.25 122.57 15.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 127.904 2.481 . . . . 0.0 109.154 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.4 tp -68.18 131.4 45.31 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.04 0.836 . . . . 0.0 111.039 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.6 mm -109.8 -39.71 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 125.462 1.505 . . . . 0.0 112.099 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.1 t -159.26 142.11 14.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.504 0.722 . . . . 0.0 110.908 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt -141.3 98.51 3.38 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.096 1.358 . . . . 0.0 109.026 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.78 92.99 2.88 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.785 1.234 . . . . 0.0 111.728 -169.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.32 -122.57 29.77 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 123.946 0.784 . . . . 0.0 111.393 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 9.7 m -81.33 7.8 10.69 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 24.7 m -129.38 136.57 50.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.99 1.716 . . . . 0.0 110.6 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.6 mt -140.84 139.76 33.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.385 1.474 . . . . 0.0 109.479 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.9 m -120.33 136.11 54.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.579 1.152 . . . . 0.0 111.232 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -121.98 149.16 43.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 112.324 170.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -101.73 148.32 25.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.275 1.83 . . . . 0.0 108.121 168.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -129.43 123.29 31.23 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.456 1.902 . . . . 0.0 109.622 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 66.2 m -95.2 110.28 22.27 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 171.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.415 HG11 ' HB3' ' A' ' 105' ' ' LEU . 17.5 t -109.09 106.34 58.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.087 -171.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -65.98 160.48 44.11 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.253 2.635 . . . . 0.0 111.203 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.4 p -107.44 150.31 26.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 112.396 -177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -75.0 -10.06 59.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 112.683 170.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -84.76 -21.95 29.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.847 1.659 . . . . 0.0 112.984 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.25 7.97 75.76 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.511 1.053 . . . . 0.0 113.568 -172.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 13.5 m -74.02 160.38 81.86 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 112.026 170.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.04 149.56 26.65 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.356 3.371 . . . . 0.0 113.67 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 43.4 p -66.09 133.07 49.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.638 1.175 . . . . 0.0 113.562 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -84.07 133.96 34.63 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.743 1.217 . . . . 0.0 110.853 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -96.75 130.54 43.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.98 0.912 . . . . 0.0 110.824 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -132.89 152.78 51.81 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.273 2.229 . . . . 0.0 110.148 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -124.66 136.19 53.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.256 1.022 . . . . 0.0 111.41 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.7 t -135.79 124.76 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.782 1.633 . . . . 0.0 109.481 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.9 m -108.01 133.03 52.9 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.652 1.181 . . . . 0.0 109.805 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -114.5 140.28 48.86 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.82 2.048 . . . . 0.0 108.819 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.6 t -132.23 127.8 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.583 1.553 . . . . 0.0 107.766 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -79.14 126.36 30.63 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.334 0.587 . . . . 0.0 111.249 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.07 131.54 15.73 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.113 1.765 . . . . 0.0 108.373 -177.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 53.6 48.28 21.99 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.307 1.043 . . . . 0.0 112.179 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 68.68 16.01 9.02 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.021 1.728 . . . . 0.0 114.229 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -142.37 134.72 27.77 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.691 1.597 . . . . 0.0 111.761 -173.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -72.75 121.11 19.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.96 1.304 . . . . 0.0 111.667 174.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -131.71 152.67 50.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.397 1.479 . . . . 0.0 111.943 -173.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.0 t -74.88 132.53 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.149 1.379 . . . . 0.0 110.404 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -82.41 6.88 15.76 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -153.98 129.97 10.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.835 1.254 . . . . 0.0 110.627 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -63.83 -37.93 89.2 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.667 1.187 . . . . 0.0 113.976 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -106.12 22.15 16.17 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.444 1.898 . . . . 0.0 112.659 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.26 65.4 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.387 1.075 . . . . 0.0 113.88 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.9 t -143.7 118.37 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.411 0 C-N-CA 126.238 1.815 . . . . 0.0 108.606 -172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 C--O 1.249 1.066 0 C-N-CA 125.969 1.708 . . . . 0.0 112.585 -176.23 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.863 -0.495 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -156.13 142.48 18.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.281 1.432 . . . . 0.0 111.588 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 12.6 p-10 -163.99 148.89 10.38 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.987 1.715 . . . . 0.0 111.318 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 m -68.09 -34.12 75.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.073 1.349 . . . . 0.0 112.855 -174.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -161.55 151.72 17.26 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.053 1.341 . . . . 0.0 111.197 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 66.08 -113.65 5.91 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.119 0.866 . . . . 0.0 112.527 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -156.24 -43.71 0.08 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.779 1.231 . . . . 0.0 112.343 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tt -88.37 128.22 35.5 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.767 1.227 . . . . 0.0 110.867 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.3 p -107.82 170.02 8.24 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.292 2.237 . . . . 0.0 113.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -55.1 -42.32 72.75 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.039 -1.038 . . . . 0.0 112.181 175.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -63.6 -49.36 73.62 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.655 0.782 . . . . 0.0 111.852 177.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -56.67 -53.5 57.02 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.119 0.967 . . . . 0.0 110.839 176.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.37 83.17 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.567 0.747 . . . . 0.0 112.146 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.11 -44.12 97.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.473 1.109 . . . . 0.0 111.616 177.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -69.28 -42.66 75.19 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.083 -1.011 . . . . 0.0 111.725 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.08 -40.76 74.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.923 0.889 . . . . 0.0 111.119 172.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.06 71.25 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.217 1.007 . . . . 0.0 111.653 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.13 -43.26 91.98 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.401 0.681 . . . . 0.0 111.857 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 t -65.97 -37.98 87.38 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 122.029 -0.419 . . . . 0.0 111.969 176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.25 -40.82 90.45 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.875 -1.141 . . . . 0.0 112.959 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.94 -41.25 97.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.403 0.547 . . . . 0.0 111.169 170.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.79 -47.35 81.24 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.551 0.74 . . . . 0.0 111.628 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -64.12 -37.78 88.68 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.226 -0.921 . . . . 0.0 112.739 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -60.77 -60.53 3.66 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.076 0.951 . . . . 0.0 110.625 174.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -65.89 -27.13 67.98 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -64.54 -55.2 22.08 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.985 0.514 . . . . 0.0 110.73 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 37.7 m -58.88 -45.38 90.32 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.178 0.991 . . . . 0.0 111.668 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.6 mmm -64.2 -13.72 50.66 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -88.02 -7.14 57.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.625 1.17 . . . . 0.0 113.057 174.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.4 4.8 67.87 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 125.261 1.41 . . . . 0.0 115.154 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -155.13 152.8 29.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.861 1.264 . . . . 0.0 113.218 -169.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -101.36 100.66 14.26 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.504 1.122 . . . . 0.0 111.123 171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.38 -9.24 21.45 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.213 3.275 . . . . 0.0 114.425 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -63.18 -23.19 67.32 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.504 1.047 . . . . 0.0 111.866 168.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.6 t -94.35 120.94 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.099 1.76 . . . . 0.0 107.633 168.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -17.33 56.52 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -169.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -155.56 109.4 2.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.677 1.991 . . . . 0.0 109.891 173.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.47 160.07 15.93 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.469 1.508 . . . . 0.0 109.815 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.9 t -79.35 105.64 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 172.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 93.8 m -103.06 116.4 62.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.747 1.219 . . . . 0.0 110.797 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.44 141.77 32.13 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.115 2.543 . . . . 0.0 110.779 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.7 p -91.27 -1.89 57.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.607 1.163 . . . . 0.0 114.046 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.7 150.02 25.02 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.262 1.411 . . . . 0.0 113.244 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -140.36 165.66 26.8 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.356 1.863 . . . . 0.0 110.494 174.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -148.62 -179.06 6.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.427 1.091 . . . . 0.0 111.694 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -128.09 131.06 49.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.48 1.112 . . . . 0.0 110.647 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -157.81 138.17 12.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.981 1.713 . . . . 0.0 110.129 -175.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 53.79 30.03 10.62 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.468 1.107 . . . . 0.0 112.9 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.3 m120 69.01 17.68 8.54 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 126.865 2.066 . . . . 0.0 114.305 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 56.1 mt -117.28 155.58 29.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.045 1.738 . . . . 0.0 110.38 175.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -88.93 127.53 35.66 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -103.2 142.17 34.62 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.914 1.686 . . . . 0.0 112.442 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.3 m -115.01 135.32 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 125.31 1.444 . . . . 0.0 109.269 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.63 140.36 46.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.517 0.727 . . . . 0.0 110.849 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.3 mmm -74.35 153.21 39.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.259 0.623 . . . . 0.0 112.224 -176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 55.8 m -68.8 160.04 31.24 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.626 -0.671 . . . . 0.0 111.476 169.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.0 p -52.32 -28.71 20.25 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 -167.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -75.33 -11.71 60.11 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.837 1.653 . . . . 0.0 113.807 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.2 mt -127.87 17.94 6.74 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.398 2.279 . . . . 0.0 110.538 174.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.82 -20.02 65.98 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 125.744 1.64 . . . . 0.0 116.62 -166.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.2 p -133.72 162.5 31.81 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.022 1.329 . . . . 0.0 109.364 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -50.67 -45.59 58.19 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.467 0.707 . . . . 0.0 112.175 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.75 -54.2 47.33 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.119 0.968 . . . . 0.0 111.667 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.4 mtpt -53.27 -39.88 64.22 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.53 1.059 . . . . 0.0 113.713 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -75.78 -41.42 53.05 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 78.4 t -61.28 -39.47 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.893 0.77 . . . . 0.0 110.621 174.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.33 -38.09 89.82 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.459 1.504 . . . . 0.0 112.417 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.35 -34.96 79.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.718 0.807 . . . . 0.0 112.572 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.75 -27.32 20.12 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.422 1.089 . . . . 0.0 113.732 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.46 -44.86 55.44 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 127.237 2.215 . . . . 0.0 114.31 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.96 -25.35 77.12 Favored 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.707 2.938 . . . . 0.0 115.149 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.4 mm -109.92 -29.46 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.683 1.193 . . . . 0.0 112.92 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -127.97 140.42 52.0 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.739 1.616 . . . . 0.0 110.612 -173.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 65.1 p -60.2 152.53 24.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.063 0.545 . . . . 0.0 109.937 173.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.42 -46.58 66.42 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.89 -0.506 . . . . 0.0 111.847 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 47.9 m -62.0 -41.32 97.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.266 1.826 . . . . 0.0 113.162 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.13 73.05 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.448 1.022 . . . . 0.0 112.535 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.76 -46.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 123.807 0.843 . . . . 0.0 109.753 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.83 -39.73 86.08 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 117.899 0.318 . . . . 0.0 111.629 175.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.6 -45.48 90.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.848 0.859 . . . . 0.0 112.509 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.25 -32.42 65.39 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 119.036 0.835 . . . . 0.0 112.233 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -61.21 -45.45 94.54 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.223 1.512 . . . . 0.0 110.546 172.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -63.97 -44.68 92.03 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.306 -0.871 . . . . 0.0 112.794 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.57 -28.27 67.64 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -108.78 11.18 26.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.253 1.421 . . . . 0.0 112.944 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 67.44 24.55 8.78 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.694 1.998 . . . . 0.0 114.103 169.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -52.19 135.11 32.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.232 1.413 . . . . 0.0 110.708 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.7 t -146.23 177.78 8.73 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.139 0.975 . . . . 0.0 111.838 -172.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.2 t -135.74 134.66 51.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.068 1.747 . . . . 0.0 108.777 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -142.9 124.94 15.26 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.566 1.146 . . . . 0.0 109.781 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 59.27 21.65 9.87 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.381 1.473 . . . . 0.0 113.626 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.82 -8.49 79.41 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.098 1.809 . . . . 0.0 114.253 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -88.01 136.78 32.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.672 1.236 . . . . 0.0 110.793 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -70.1 139.64 52.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.837 0.855 . . . . 0.0 108.966 173.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.409 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.19 152.74 48.94 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.984 0.913 . . . . 0.0 112.989 170.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -135.59 150.78 73.04 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.957 1.703 . . . . 0.0 110.037 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.56 145.32 57.91 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.215 1.943 . . . . 0.0 110.546 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.18 133.31 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.859 0.864 . . . . 0.0 111.267 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -167.3 172.42 42.28 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.184 1.849 . . . . 0.0 112.814 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -163.76 143.8 8.42 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.016 1.726 . . . . 0.0 110.737 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 176.64 170.52 39.29 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.796 0.712 . . . . 0.0 114.704 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -153.0 2.33 0.3 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.231 1.812 . . . . 0.0 113.122 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 60.63 165.9 0.08 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 127.693 2.397 . . . . 0.0 113.836 -169.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.13 0.14 56.39 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.419 1.087 . . . . 0.0 112.304 168.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 31.4 mt -84.2 130.27 34.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.886 2.074 . . . . 0.0 111.187 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -100.06 85.38 3.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.571 1.148 . . . . 0.0 110.56 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -71.68 -26.82 62.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.528 0.731 . . . . 0.0 112.468 -174.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -61.79 -17.11 54.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.803 1.241 . . . . 0.0 113.709 173.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -111.77 -1.24 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.904 1.682 . . . . 0.0 113.226 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.8 p -70.74 164.29 25.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.048 0.939 . . . . 0.0 113.524 175.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.1 p -136.76 142.91 43.01 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.098 1.359 . . . . 0.0 110.93 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.27 153.72 17.65 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -145.02 124.77 13.33 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.168 2.587 . . . . 0.0 109.125 -176.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -71.59 133.74 45.95 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.223 0.92 . . . . 0.0 111.486 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.7 mm -112.79 -40.54 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 125.573 1.549 . . . . 0.0 112.587 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.8 t -158.14 145.82 18.34 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.943 0.897 . . . . 0.0 110.665 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -145.93 102.07 3.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.086 0.954 . . . . 0.0 111.133 -173.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -112.88 178.95 4.11 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 126.732 2.013 . . . . 0.0 110.759 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -61.74 -33.53 85.51 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 124.106 0.86 . . . . 0.0 114.724 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.9 m -137.88 8.91 2.8 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 33.7 m -139.96 131.89 27.72 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.238 1.815 . . . . 0.0 109.233 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 91.6 mt -139.98 137.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.781 1.232 . . . . 0.0 109.331 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 35.7 m -119.58 133.31 55.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.44 1.096 . . . . 0.0 111.062 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -121.0 147.68 45.15 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.786 1.634 . . . . 0.0 111.87 170.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.76 146.67 27.44 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.19 1.796 . . . . 0.0 107.86 168.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -126.3 127.77 46.08 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.132 1.773 . . . . 0.0 109.402 -177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 58.9 m -96.34 113.9 25.53 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.7 t -114.55 105.6 53.41 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 123.884 0.874 . . . . 0.0 110.563 -169.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.53 157.47 50.86 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.205 2.603 . . . . 0.0 111.05 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 9.7 p -113.67 153.68 28.52 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.675 0.75 . . . . 0.0 112.673 -172.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -87.01 -6.37 58.77 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.622 1.569 . . . . 0.0 112.332 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -94.52 -8.0 39.6 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.549 1.54 . . . . 0.0 113.113 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.14 8.35 66.79 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.109 1.337 . . . . 0.0 114.532 177.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 71.6 m -79.36 155.28 76.74 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.903 1.281 . . . . 0.0 112.297 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -54.08 146.23 49.42 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.052 3.168 . . . . 0.0 112.509 171.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -61.86 124.36 20.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.955 0.902 . . . . 0.0 113.352 -172.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.18 138.1 37.72 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.005 1.722 . . . . 0.0 112.022 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -93.69 130.65 39.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.766 0.826 . . . . 0.0 110.763 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -133.59 147.92 51.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.326 2.25 . . . . 0.0 109.063 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -124.24 137.54 54.5 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.923 1.238 . . . . 0.0 111.647 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.2 t -138.95 120.96 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.318 1.447 . . . . 0.0 109.889 -169.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.1 m -110.36 124.6 51.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.754 1.221 . . . . 0.0 109.666 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -104.39 138.49 40.72 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.663 1.985 . . . . 0.0 108.914 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.8 t -128.28 130.71 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.088 1.755 . . . . 0.0 107.961 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -83.75 103.22 12.86 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.035 -0.416 . . . . 0.0 110.282 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -84.29 -42.21 16.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.731 0.812 . . . . 0.0 112.037 -171.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -162.49 93.52 0.85 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.371 1.468 . . . . 0.0 109.979 176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 62.35 0.13 0.57 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.381 1.473 . . . . 0.0 114.686 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -142.03 124.95 16.11 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.828 1.651 . . . . 0.0 111.865 -169.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -73.97 133.12 42.98 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.488 1.515 . . . . 0.0 111.872 173.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -152.23 154.79 36.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.494 1.518 . . . . 0.0 111.904 -176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.2 t -78.07 134.88 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.291 1.436 . . . . 0.0 111.182 -170.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -79.5 7.67 7.72 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -155.73 133.83 11.44 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.037 1.335 . . . . 0.0 110.269 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -70.37 -47.98 58.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 0.0 113.056 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -86.34 15.72 5.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.378 1.471 . . . . 0.0 113.22 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.13 -32.08 69.53 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.451 1.101 . . . . 0.0 112.355 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 19.0 t -142.47 126.8 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 C-N-CA 126.178 1.791 . . . . 0.0 108.743 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.875 1.67 . . . . 0.0 110.749 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.805 -0.518 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -85.53 -11.51 53.96 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -65.9 132.74 49.35 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.557 1.143 . . . . 0.0 112.468 179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.4 p -86.72 -35.72 19.08 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.608 1.563 . . . . 0.0 112.762 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.5 t -164.09 143.39 7.73 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.866 1.667 . . . . 0.0 111.275 174.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -103.78 4.93 46.61 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.177 1.37 . . . . 0.0 113.917 175.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.438 ' HA ' ' HE1' ' A' ' 150' ' ' TRP . 74.1 m-20 -117.51 154.97 30.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.994 1.397 . . . . 0.0 112.611 -172.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.24 146.61 32.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.096 1.359 . . . . 0.0 113.048 -167.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 t -144.58 173.72 11.57 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.349 2.26 . . . . 0.0 110.837 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.22 -44.36 71.62 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.515 1.126 . . . . 0.0 113.464 -172.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -62.55 -47.03 85.65 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.409 0.684 . . . . 0.0 112.245 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -57.76 -54.54 45.77 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.561 1.145 . . . . 0.0 110.324 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.63 79.36 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.736 0.698 . . . . 0.0 111.737 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.66 -46.96 77.43 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.017 1.327 . . . . 0.0 111.881 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -72.19 -41.62 66.77 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.342 -0.849 . . . . 0.0 111.916 -178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.4 mt -55.25 -40.68 71.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.125 0.97 . . . . 0.0 110.935 172.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.04 -50.01 67.9 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.14 0.976 . . . . 0.0 111.723 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.22 -43.2 92.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.424 0.689 . . . . 0.0 112.209 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 t -67.07 -36.71 82.61 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.52 86.73 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.714 -1.241 . . . . 0.0 112.683 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.04 97.27 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.419 0.688 . . . . 0.0 111.615 170.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.42 -49.55 77.39 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.491 0.717 . . . . 0.0 111.587 174.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.23 -40.34 93.93 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.268 -0.895 . . . . 0.0 113.006 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 159' ' ' ILE . 46.1 t80 -64.39 -56.23 15.72 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.815 0.846 . . . . 0.0 111.549 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -63.43 -30.07 71.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -64.32 -53.34 50.27 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.545 0.611 . . . . 0.0 111.115 169.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.6 m -58.42 -46.86 85.62 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.109 0.964 . . . . 0.0 111.962 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.2 mmm -64.9 -11.6 39.79 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -90.67 -3.31 57.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.783 1.233 . . . . 0.0 113.132 172.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.45 1.6 77.86 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.484 1.516 . . . . 0.0 115.296 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -156.33 153.47 29.07 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.495 1.147 . . . . 0.0 113.818 -169.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -99.38 98.19 6.45 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.916 1.287 . . . . 0.0 111.136 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.73 -10.56 22.81 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 124.323 3.349 . . . . 0.0 114.752 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -65.3 -22.5 66.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.356 0.98 . . . . 0.0 112.6 169.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 80.7 t -92.3 120.27 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 125.771 1.628 . . . . 0.0 108.125 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.13 -13.38 59.96 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -171.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -151.7 117.22 5.37 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.779 1.632 . . . . 0.0 110.909 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -150.54 147.66 27.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.535 1.934 . . . . 0.0 108.881 176.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.8 t -104.71 113.23 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.152 0.981 . . . . 0.0 109.718 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 36.4 m -86.81 118.33 69.97 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.89 135.53 58.11 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.169 2.58 . . . . 0.0 111.805 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -79.71 -3.26 46.65 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.98 159.0 33.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 125.16 1.362 . . . . 0.0 112.835 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.7 p -139.46 162.77 34.24 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.375 1.87 . . . . 0.0 109.533 173.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -145.63 171.35 14.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.339 0.656 . . . . 0.0 112.568 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -116.54 129.11 56.0 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.533 1.133 . . . . 0.0 110.53 -177.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -159.24 139.42 12.05 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.669 1.588 . . . . 0.0 110.511 -174.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 53.79 27.5 7.13 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.597 1.159 . . . . 0.0 113.306 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.87 20.87 6.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.373 1.869 . . . . 0.0 113.742 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.0 mt -122.65 159.93 26.86 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.53 1.932 . . . . 0.0 110.383 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -94.07 129.92 40.42 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 168.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.58 149.33 27.28 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.186 1.794 . . . . 0.0 112.832 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -126.69 138.93 53.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.52 1.128 . . . . 0.0 109.473 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -75.26 142.91 43.28 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.435 0.694 . . . . 0.0 112.286 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.3 mmm -74.38 154.33 38.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.599 0.759 . . . . 0.0 112.299 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 5.5 m -68.31 154.2 42.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.921 0.889 . . . . 0.0 111.533 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -38.87 -40.18 0.61 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 -171.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.28 -12.02 60.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.17 1.35 . . . . 0.0 113.939 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.2 mt -126.8 16.2 7.45 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.932 2.493 . . . . 0.0 110.529 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.61 63.88 Favored Glycine 0 N--CA 1.472 1.089 0 C-N-CA 125.593 1.568 . . . . 0.0 116.699 -167.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.3 p -134.7 162.61 31.84 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.085 1.354 . . . . 0.0 109.165 171.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -50.8 -45.76 59.41 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.5 0.72 . . . . 0.0 112.188 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.95 -54.01 49.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.118 0.967 . . . . 0.0 111.693 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.4 mtpt -53.32 -40.66 65.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.494 1.043 . . . . 0.0 113.638 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.98 -43.59 57.59 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.7 t -59.44 -41.89 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 118.667 0.667 . . . . 0.0 110.475 175.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -64.53 -36.26 83.62 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.653 1.581 . . . . 0.0 112.751 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -68.23 -34.48 76.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.167 0.987 . . . . 0.0 112.487 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -87.31 -25.94 23.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.567 1.147 . . . . 0.0 113.614 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.99 -45.34 51.29 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.569 2.348 . . . . 0.0 114.275 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -58.14 -25.79 72.99 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.924 3.082 . . . . 0.0 115.387 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 mm -108.22 -35.93 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.697 1.199 . . . . 0.0 112.418 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -122.73 141.16 52.09 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.54 1.536 . . . . 0.0 110.521 -169.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 78.9 p -64.36 158.29 23.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.149 0.58 . . . . 0.0 109.9 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -51.33 -51.54 53.53 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.565 -0.71 . . . . 0.0 110.931 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.8 t -61.5 -34.77 76.06 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.062 0.945 . . . . 0.0 112.819 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.71 96.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.523 1.056 . . . . 0.0 112.511 173.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.58 -48.56 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.897 0.879 . . . . 0.0 110.232 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.09 -43.35 95.57 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.21 0.459 . . . . 0.0 111.611 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -60.54 -46.2 91.05 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.801 0.84 . . . . 0.0 112.372 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.45 -32.8 64.55 Favored Glycine 0 CA--C 1.53 1.006 0 CA-C-N 118.784 0.72 . . . . 0.0 112.49 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.64 -44.91 96.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.151 1.476 . . . . 0.0 110.588 172.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.88 -44.31 85.71 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.231 -0.918 . . . . 0.0 112.816 174.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.23 -28.47 67.27 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -107.46 9.97 29.55 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.162 1.385 . . . . 0.0 112.923 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 68.28 23.84 7.62 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.867 2.067 . . . . 0.0 114.107 169.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -51.82 134.05 31.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.455 1.502 . . . . 0.0 110.779 175.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.5 t -145.94 177.84 8.64 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.112 0.965 . . . . 0.0 111.836 -172.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -134.09 131.97 55.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 125.975 1.71 . . . . 0.0 108.432 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.4 t -137.41 122.77 19.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.695 1.198 . . . . 0.0 109.716 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? 51.47 40.32 26.53 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.713 1.205 . . . . 0.0 111.916 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.74 -9.83 49.39 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 126.764 2.126 . . . . 0.0 115.692 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -97.21 136.7 37.34 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.012 1.325 . . . . 0.0 111.763 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.25 139.83 56.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.167 0.987 . . . . 0.0 109.203 176.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -139.9 151.67 45.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.208 1.003 . . . . 0.0 112.955 173.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.6 m -132.48 150.96 77.33 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.86 1.664 . . . . 0.0 110.272 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.36 145.9 34.78 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.54 2.16 . . . . 0.0 111.676 -177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.56 132.59 28.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 110.541 171.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.54 -169.49 32.03 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 125.731 1.634 . . . . 0.0 112.788 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -157.82 140.79 15.03 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.4 1.48 . . . . 0.0 110.857 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -163.61 151.69 21.29 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.476 1.036 . . . . 0.0 113.391 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -168.33 136.65 2.25 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.758 2.023 . . . . 0.0 109.757 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -106.98 138.94 42.19 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.189 0.996 . . . . 0.0 111.774 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.46 20.8 0.07 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.441 1.896 . . . . 0.0 114.358 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.468 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.9 mt -104.51 121.2 42.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.543 2.337 . . . . 0.0 110.974 -171.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.628 ' HB2' HD21 ' A' ' 131' ' ' LEU . 55.6 t-20 -93.82 94.55 8.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.068 0.947 . . . . 0.0 110.803 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -76.86 -24.73 52.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.86 0.864 . . . . 0.0 112.231 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.85 -17.74 64.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.009 0.924 . . . . 0.0 113.376 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -107.95 0.21 21.79 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.781 1.632 . . . . 0.0 113.254 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 26.7 p -71.57 166.61 21.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.4 p -134.14 141.55 47.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.999 1.32 . . . . 0.0 110.802 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.97 142.41 28.96 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.83 1.252 . . . . 0.0 112.835 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -132.9 121.62 23.15 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 128.307 2.643 . . . . 0.0 109.111 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.17 132.04 47.56 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.029 0.831 . . . . 0.0 110.791 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.8 mm -108.76 -41.65 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.228 1.411 . . . . 0.0 111.834 178.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.8 t -162.31 147.11 12.41 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.167 0.587 . . . . 0.0 111.666 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -138.74 101.97 4.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.48 1.512 . . . . 0.0 109.063 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -131.89 88.39 2.55 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.264 1.425 . . . . 0.0 111.057 -169.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.56 -118.86 15.79 Favored Glycine 0 N--CA 1.47 0.924 0 C-N-CA 123.864 0.745 . . . . 0.0 111.538 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 m -81.18 6.3 14.33 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -130.3 136.73 49.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.03 1.732 . . . . 0.0 110.568 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.3 mt -140.39 141.34 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 125.549 1.539 . . . . 0.0 109.654 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.7 m -122.99 137.14 55.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.576 1.15 . . . . 0.0 111.623 178.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -123.05 150.46 43.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.321 1.848 . . . . 0.0 112.181 171.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -101.31 144.63 29.91 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.509 1.924 . . . . 0.0 107.331 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -121.65 126.15 48.34 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.954 1.702 . . . . 0.0 109.742 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 44.5 m -99.2 109.12 21.83 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.6 t -111.84 107.14 56.44 Favored Pre-proline 0 N--CA 1.469 0.498 0 C-N-CA 123.476 0.71 . . . . 0.0 111.015 -169.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -63.92 153.09 77.79 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.41 2.74 . . . . 0.0 111.464 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.6 p -111.59 152.74 27.24 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.669 0.747 . . . . 0.0 112.41 -174.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 106' ' ' ASN . 1.5 mm? -91.5 -4.14 55.8 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.985 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -79.14 -21.1 47.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.242 1.817 . . . . 0.0 112.251 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.92 7.46 68.32 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.863 1.22 . . . . 0.0 113.648 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.4 m -75.69 156.18 84.9 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.388 1.075 . . . . 0.0 111.967 171.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.03 147.54 42.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 124.05 3.167 . . . . 0.0 113.096 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.5 m -59.46 127.74 33.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.244 1.018 . . . . 0.0 113.544 -174.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.33 136.58 36.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.314 1.445 . . . . 0.0 112.035 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -84.06 137.45 33.57 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.721 0.809 . . . . 0.0 112.383 169.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -136.72 153.94 50.73 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.849 2.46 . . . . 0.0 108.207 173.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -124.9 137.66 54.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.165 0.986 . . . . 0.0 110.858 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 39.4 t -138.09 120.87 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.231 1.412 . . . . 0.0 109.697 -170.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 100.0 m -109.2 134.73 51.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.849 1.259 . . . . 0.0 109.819 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -117.07 142.54 46.86 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.626 1.97 . . . . 0.0 108.997 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 79.4 t -131.85 128.74 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.83 1.652 . . . . 0.0 108.244 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.437 ' HE3' ' CZ2' ' A' ' 150' ' ' TRP . 23.8 ttmt -81.44 105.02 12.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.232 0.613 . . . . 0.0 110.563 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -88.35 -38.01 15.48 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -160.62 90.18 0.85 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.846 1.258 . . . . 0.0 110.363 175.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.1 mttm 62.35 4.3 1.26 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 113.919 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -147.94 134.15 19.43 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.305 1.842 . . . . 0.0 111.744 -168.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . 0.438 ' HE1' ' HA ' ' A' ' 7' ' ' ASP . 97.7 m95 -81.17 128.78 34.14 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.544 1.937 . . . . 0.0 112.849 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -132.69 151.56 51.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.677 1.591 . . . . 0.0 111.521 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.3 t -71.98 133.12 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.246 1.418 . . . . 0.0 110.12 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -82.24 5.38 20.13 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -176.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -154.86 131.54 10.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.798 1.239 . . . . 0.0 110.572 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.6 -43.02 90.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.236 1.014 . . . . 0.0 113.469 -174.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.53 18.02 13.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.029 1.731 . . . . 0.0 113.108 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.29 -30.24 66.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.068 0.947 . . . . 0.0 112.81 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 46.6 t -143.28 126.73 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 126.435 1.894 . . . . 0.0 108.87 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.4 pt . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.485 1.514 . . . . 0.0 112.318 -176.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp 62.66 28.9 16.79 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 125.73 1.612 . . . . 0.0 113.605 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -79.21 -5.61 54.68 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.153 1.381 . . . . 0.0 114.3 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -70.08 160.7 31.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.953 . . . . 0.0 112.241 178.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.3 t -157.1 158.43 36.39 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.068 1.347 . . . . 0.0 110.964 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.93 -121.21 5.45 Favored Glycine 0 N--CA 1.468 0.806 0 C-N-CA 124.334 0.969 . . . . 0.0 111.008 -171.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -158.8 -42.49 0.06 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.267 1.027 . . . . 0.0 112.822 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -89.26 129.91 35.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.524 1.13 . . . . 0.0 110.383 173.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.5 t -120.28 171.13 8.72 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.224 1.81 . . . . 0.0 112.361 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -53.62 -43.98 69.13 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.327 1.451 . . . . 0.0 113.246 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -52.56 63.23 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.648 0.779 . . . . 0.0 111.909 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -54.49 -50.84 66.83 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.025 0.93 . . . . 0.0 111.303 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.17 80.04 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.675 1.125 . . . . 0.0 112.423 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.15 -43.58 95.63 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.757 1.223 . . . . 0.0 111.804 177.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.42 -42.14 71.98 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 120.993 -1.067 . . . . 0.0 111.687 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.4 mt -55.05 -41.44 71.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.745 0.818 . . . . 0.0 111.068 171.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.97 72.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.346 1.058 . . . . 0.0 112.116 177.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.24 -39.74 93.83 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.612 -0.68 . . . . 0.0 112.325 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.6 t -66.63 -40.52 88.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.931 -0.481 . . . . 0.0 111.735 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.05 -34.1 75.62 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.927 -1.108 . . . . 0.0 112.415 173.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -56.59 -54.34 47.06 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.748 0.819 . . . . 0.0 111.363 171.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -71.83 -36.36 70.19 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -64.23 -44.8 90.76 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.566 0.621 . . . . 0.0 112.082 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.406 ' CE1' HG21 ' A' ' 159' ' ' ILE . 61.5 t80 -63.04 -54.0 44.96 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.593 0.757 . . . . 0.0 111.268 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -63.37 -39.2 93.88 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -176.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -73.06 -26.29 61.22 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.9 m -69.92 -45.37 67.7 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.785 170.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.67 -29.93 69.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.174 0.989 . . . . 0.0 112.846 171.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -77.95 -7.46 56.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.063 1.345 . . . . 0.0 113.843 174.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.407 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 79.24 9.46 86.98 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 125.664 1.602 . . . . 0.0 115.491 175.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -166.55 127.55 1.69 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.554 1.542 . . . . 0.0 113.12 -169.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -78.35 112.27 24.83 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 124.774 1.23 . . . . 0.0 111.214 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -62.36 -15.81 47.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.524 3.482 . . . . 0.0 114.104 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -68.28 -21.6 64.79 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 173.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.59 123.85 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.639 1.575 . . . . 0.0 109.042 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -105.67 -3.54 22.06 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -172.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -131.49 19.41 4.76 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.304 1.442 . . . . 0.0 113.744 -171.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.92 135.2 50.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.137 0.975 . . . . 0.0 110.831 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 64.4 t -88.68 143.78 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.335 1.454 . . . . 0.0 107.593 169.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -147.42 119.3 4.64 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-O 118.213 -0.899 . . . . 0.0 112.0 -171.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -57.27 133.22 55.93 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.578 2.852 . . . . 0.0 112.538 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.6 m -81.77 -3.6 54.24 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 178.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.7 165.74 31.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.803 1.668 . . . . 0.0 113.595 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.2 p -141.85 167.58 21.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.602 1.961 . . . . 0.0 110.259 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -145.8 178.95 7.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.129 176.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.17 130.7 52.68 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.629 1.171 . . . . 0.0 110.66 -177.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -159.19 138.86 11.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.93 1.692 . . . . 0.0 110.378 -174.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 53.36 28.2 7.14 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.551 1.14 . . . . 0.0 113.164 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 70.84 16.34 6.65 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 127.049 2.14 . . . . 0.0 114.289 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.5 mt -116.94 156.95 26.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.241 1.816 . . . . 0.0 110.414 177.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -89.91 128.93 36.31 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -106.43 145.23 32.01 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.984 1.714 . . . . 0.0 112.907 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.8 m -118.15 137.4 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.003 1.321 . . . . 0.0 109.502 174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -70.83 141.4 51.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.688 0.795 . . . . 0.0 111.83 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.407 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 16.7 mmm -73.58 151.67 40.84 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 111.664 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.9 m -77.05 163.15 26.93 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.867 -0.521 . . . . 0.0 111.061 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -43.15 -33.57 0.92 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -169.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.29 -18.23 62.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.926 2.091 . . . . 0.0 114.618 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -132.31 19.3 4.41 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.531 2.332 . . . . 0.0 109.839 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.13 -22.73 63.19 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.923 1.725 . . . . 0.0 116.862 -166.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 11.2 p -134.19 162.79 31.17 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.042 1.337 . . . . 0.0 109.12 171.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -51.1 -44.11 61.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.354 0.662 . . . . 0.0 112.046 -178.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.13 -54.66 42.5 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.109 0.963 . . . . 0.0 111.666 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.1 mtpt -54.09 -38.43 65.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.809 1.186 . . . . 0.0 113.727 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.4 -45.97 51.51 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 176.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.8 t -58.76 -41.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.663 0.665 . . . . 0.0 110.503 175.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.81 -39.21 93.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.75 1.62 . . . . 0.0 112.474 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -67.34 -34.14 76.72 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.282 -0.886 . . . . 0.0 112.764 175.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -86.78 -26.39 24.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.502 1.121 . . . . 0.0 113.652 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -45.82 -46.24 38.77 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 127.37 2.268 . . . . 0.0 113.988 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -57.7 -25.5 68.46 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.009 3.14 . . . . 0.0 115.649 176.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 24.7 mm -111.27 -34.5 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.832 1.253 . . . . 0.0 112.821 -172.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -124.69 141.83 51.83 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.552 1.541 . . . . 0.0 110.256 -170.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.6 p -65.46 154.99 36.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.808 0.443 . . . . 0.0 110.339 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -44.81 -49.76 10.58 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.761 0.824 . . . . 0.0 111.491 173.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -61.45 -46.8 88.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.321 1.449 . . . . 0.0 112.585 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.64 -35.78 77.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.998 0.817 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.8 mt -68.56 -50.89 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.748 0.819 . . . . 0.0 110.095 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.59 -40.53 97.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.305 0.502 . . . . 0.0 111.732 -178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -60.68 -45.93 92.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.879 0.871 . . . . 0.0 111.994 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -75.51 -11.05 84.6 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.135 -0.814 . . . . 0.0 114.051 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -81.54 -49.52 10.47 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.284 1.542 . . . . 0.0 108.955 167.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -45.88 92.72 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -66.63 -22.55 66.11 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -109.84 8.13 24.34 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.706 1.602 . . . . 0.0 113.099 178.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 66.25 26.95 10.34 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.305 1.842 . . . . 0.0 113.459 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -56.4 140.62 44.98 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 110.83 175.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.4 t -148.39 178.03 8.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.004 0.921 . . . . 0.0 112.285 -172.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.5 t -131.06 132.78 63.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 126.131 1.772 . . . . 0.0 108.263 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 34.4 t -135.49 125.98 26.83 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.966 1.306 . . . . 0.0 109.03 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm 58.5 31.16 20.69 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.14 0.976 . . . . 0.0 112.421 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.78 -7.4 62.51 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.8 2.143 . . . . 0.0 115.097 -177.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -98.72 137.54 37.18 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.612 1.565 . . . . 0.0 111.484 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.84 142.66 57.25 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.904 0.882 . . . . 0.0 109.054 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.401 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -142.34 151.34 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.724 0.809 . . . . 0.0 112.649 172.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.95 148.81 71.37 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.173 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.78 146.58 48.55 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.471 2.114 . . . . 0.0 111.138 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt -63.95 134.3 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.115 0.966 . . . . 0.0 110.958 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.95 -176.8 48.21 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.229 1.871 . . . . 0.0 112.428 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -161.06 155.6 23.36 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.83 1.652 . . . . 0.0 110.979 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -169.6 162.35 35.85 Favored Glycine 0 CA--C 1.528 0.844 0 CA-C-O 121.82 0.678 . . . . 0.0 114.141 -178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -166.39 170.7 12.74 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.167 2.587 . . . . 0.0 110.174 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -140.67 143.86 35.36 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.18 0.992 . . . . 0.0 111.368 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.72 -3.54 9.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.748 1.219 . . . . 0.0 114.035 169.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.427 ' HB3' HG11 ' A' ' 128' ' ' VAL . 61.2 mt -68.57 121.49 16.51 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.047 1.739 . . . . 0.0 110.778 178.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -98.86 81.39 2.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.895 1.278 . . . . 0.0 110.664 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -68.31 -26.26 65.54 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.49 0.716 . . . . 0.0 112.25 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -62.17 -17.85 59.23 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.15 1.38 . . . . 0.0 113.735 172.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.4 0.34 14.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.786 1.634 . . . . 0.0 113.064 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.1 p -70.37 165.88 21.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.082 0.953 . . . . 0.0 113.176 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 34.6 p -133.39 138.76 46.42 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.698 1.199 . . . . 0.0 110.713 177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.14 149.45 21.48 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.324 1.05 . . . . 0.0 113.336 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -139.04 125.0 19.85 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 127.9 2.48 . . . . 0.0 108.879 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.5 tp -68.4 131.2 44.89 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.713 0.688 . . . . 0.0 110.685 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 51.2 mm -107.63 -41.4 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.196 1.398 . . . . 0.0 111.954 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.6 t -160.72 147.47 15.35 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.53 0.732 . . . . 0.0 111.07 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -145.02 95.13 2.64 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.1 1.36 . . . . 0.0 109.259 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -127.77 88.28 2.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.954 1.701 . . . . 0.0 111.234 -168.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 58.68 -115.78 7.67 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.821 0.724 . . . . 0.0 111.679 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 m -81.52 4.6 20.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -131.2 135.42 47.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.703 1.601 . . . . 0.0 110.753 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.3 mt -140.49 140.02 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.417 1.487 . . . . 0.0 109.593 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.1 m -121.09 135.37 55.2 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.677 1.191 . . . . 0.0 111.083 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -121.79 148.71 44.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.61 1.564 . . . . 0.0 112.149 170.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -101.78 145.84 28.61 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.913 1.685 . . . . 0.0 107.992 167.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -125.73 122.93 37.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.448 1.899 . . . . 0.0 109.215 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 52.8 m -95.05 110.93 22.8 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 171.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 105' ' ' LEU . 14.6 t -110.64 105.82 57.39 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 123.99 0.916 . . . . 0.0 110.578 -169.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.62 160.36 40.48 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.498 2.799 . . . . 0.0 111.31 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 15.8 p -111.19 152.51 26.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.619 0.724 . . . . 0.0 112.562 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.12 -5.21 55.56 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.42 1.488 . . . . 0.0 112.976 173.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -102.38 -7.21 22.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.472 . . . . 0.0 113.283 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.91 7.69 70.39 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.946 1.26 . . . . 0.0 114.427 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.4 m -75.03 155.59 86.42 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.131 173.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -54.12 144.32 58.92 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.1 3.2 . . . . 0.0 113.088 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.6 m -62.98 128.12 34.38 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.329 1.052 . . . . 0.0 113.428 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.06 135.44 36.34 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.05 1.34 . . . . 0.0 111.665 -178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -89.58 133.26 34.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.203 0.601 . . . . 0.0 111.896 170.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -132.26 151.26 51.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.812 2.445 . . . . 0.0 109.512 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.42 135.84 53.58 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.237 1.015 . . . . 0.0 111.42 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.1 t -136.78 124.05 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.652 1.581 . . . . 0.0 109.438 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -109.55 130.29 55.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.659 1.183 . . . . 0.0 110.007 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -111.24 137.06 49.43 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.85 2.06 . . . . 0.0 108.632 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 92.6 t -128.81 125.95 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.68 1.592 . . . . 0.0 107.725 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -77.26 120.7 22.66 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.151 0.432 . . . . 0.0 110.572 173.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -108.22 -111.82 0.3 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.778 1.231 . . . . 0.0 109.045 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -77.16 72.66 3.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.125 1.37 . . . . 0.0 111.396 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 63.37 18.32 10.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.95 2.1 . . . . 0.0 114.094 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -142.27 133.3 25.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.013 1.725 . . . . 0.0 110.93 -175.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -72.53 119.23 16.46 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.187 1.395 . . . . 0.0 111.381 169.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -128.29 150.3 50.12 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.398 1.479 . . . . 0.0 111.547 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 13.2 t -72.66 132.78 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.986 1.314 . . . . 0.0 109.945 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -80.62 7.13 10.76 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -153.58 132.05 12.11 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.558 1.543 . . . . 0.0 109.832 -175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.9 -40.82 71.96 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.59 19.28 11.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.877 1.671 . . . . 0.0 113.06 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.09 -26.28 66.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.0 t -145.42 119.6 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.412 0 C-N-CA 126.176 1.79 . . . . 0.0 108.84 -173.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.406 HG21 ' CE1' ' A' ' 24' ' ' PHE . 4.2 pt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 125.8 1.64 . . . . 0.0 112.966 -175.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -68.47 -10.2 53.88 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -56.82 -17.69 10.2 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.571 1.548 . . . . 0.0 114.556 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.1 p -59.04 -21.19 58.71 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.293 1.437 . . . . 0.0 113.902 170.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.6 m -87.2 -9.82 54.16 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -112.35 -21.48 6.19 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 125.73 1.633 . . . . 0.0 114.376 177.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -96.27 160.39 14.45 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 176.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -88.81 146.33 25.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.32 1.448 . . . . 0.0 110.597 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.3 t -138.91 173.56 11.44 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.224 1.81 . . . . 0.0 111.37 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -54.52 -43.6 72.04 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 113.087 -172.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -62.25 -53.83 49.59 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.736 0.815 . . . . 0.0 111.612 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -51.01 -55.37 17.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 110.913 174.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.22 -49.35 72.19 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.521 0.728 . . . . 0.0 111.715 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.82 -47.51 73.97 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.962 1.305 . . . . 0.0 112.254 176.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -72.26 -39.83 68.12 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.309 -0.87 . . . . 0.0 112.602 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -56.18 -39.9 73.1 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.073 0.949 . . . . 0.0 110.538 173.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.26 -48.47 70.36 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.126 0.97 . . . . 0.0 111.843 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.08 -40.24 97.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.274 0.63 . . . . 0.0 112.313 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.8 t -67.74 -35.91 79.59 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.651 -0.656 . . . . 0.0 111.655 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.422 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -65.96 -37.84 87.04 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 120.724 -1.235 . . . . 0.0 112.141 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -54.29 -50.28 67.68 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.512 1.125 . . . . 0.0 110.363 169.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.82 -43.83 95.07 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.963 1.305 . . . . 0.0 111.909 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -71.29 -40.67 70.73 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.799 0.84 . . . . 0.0 113.254 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 159' ' ' ILE . 58.5 t80 -63.83 -57.5 9.69 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.677 0.791 . . . . 0.0 111.257 177.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -60.82 -38.21 84.66 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.51 -31.56 67.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.8 m -70.41 -43.68 69.48 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.703 -0.623 . . . . 0.0 110.455 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 81.5 mmm -62.1 -24.35 67.08 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.851 . . . . 0.0 113.226 170.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.1 m -84.28 -3.11 58.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.357 1.463 . . . . 0.0 114.065 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.67 2.54 75.65 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.305 1.431 . . . . 0.0 116.225 171.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -163.09 138.84 6.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.625 1.17 . . . . 0.0 113.678 -171.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -94.28 108.11 33.87 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.865 1.266 . . . . 0.0 113.113 176.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -64.63 -9.12 19.47 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.387 3.391 . . . . 0.0 114.043 -177.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -61.74 -24.39 66.78 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.816 0.846 . . . . 0.0 112.179 168.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.89 125.22 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.228 1.811 . . . . 0.0 108.836 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.97 119.99 34.43 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 110.404 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.8 tttt 64.24 51.11 2.2 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.817 1.647 . . . . 0.0 113.137 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.75 155.7 18.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.276 1.031 . . . . 0.0 109.986 168.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.8 t -78.89 104.51 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.76 110.83 64.62 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.745 1.218 . . . . 0.0 111.083 -174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.79 138.44 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.211 2.608 . . . . 0.0 110.601 176.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.0 p -94.21 -0.74 54.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -82.24 156.53 35.76 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 125.097 1.332 . . . . 0.0 113.513 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.413 HG22 HG12 ' A' ' 53' ' ' VAL . 65.6 p -140.53 166.0 25.92 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.259 1.824 . . . . 0.0 110.779 175.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -150.09 -179.53 7.25 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.597 1.159 . . . . 0.0 111.623 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -123.89 130.95 53.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.536 1.134 . . . . 0.0 110.721 -178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -157.75 136.58 11.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.899 1.68 . . . . 0.0 110.425 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 56.01 27.92 12.0 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.62 1.168 . . . . 0.0 113.003 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.53 20.18 7.22 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.316 1.846 . . . . 0.0 113.466 -176.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.6 mt -119.54 153.98 34.57 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.421 1.888 . . . . 0.0 110.186 176.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -88.39 128.09 35.51 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 168.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -105.97 142.79 35.08 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.776 1.63 . . . . 0.0 112.489 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 HG22 ' A' ' 44' ' ' THR . 9.2 m -115.24 136.14 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.687 1.595 . . . . 0.0 109.56 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.1 142.05 43.69 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.078 173.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 45.0 mmm -77.81 153.02 33.18 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.586 0.754 . . . . 0.0 112.319 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 49.0 m -69.39 156.9 38.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.54 -0.725 . . . . 0.0 111.662 170.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 p -42.08 -42.47 2.92 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 118.517 2.784 . . . . 0.0 118.517 -167.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.73 -13.83 60.65 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.504 1.502 . . . . 0.0 113.679 -178.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.2 mt -115.12 13.03 16.76 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.627 1.971 . . . . 0.0 110.291 168.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.23 -14.1 61.17 Favored Glycine 0 N--CA 1.471 1.031 0 C-N-CA 125.611 1.577 . . . . 0.0 116.131 -167.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -137.3 157.22 47.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.666 1.586 . . . . 0.0 108.499 174.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 mmmt -51.67 -49.33 62.58 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.448 0.699 . . . . 0.0 111.689 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.08 -52.28 63.71 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.661 0.784 . . . . 0.0 111.848 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.93 -47.36 21.64 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.415 1.486 . . . . 0.0 113.658 172.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.37 -40.47 62.08 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 74.3 t -57.6 -41.29 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.583 0.753 . . . . 0.0 110.194 173.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -61.69 -36.84 82.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.18 1.392 . . . . 0.0 112.804 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -71.61 -35.07 70.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.278 -0.889 . . . . 0.0 112.625 175.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -83.53 -26.96 29.68 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.23 1.012 . . . . 0.0 113.607 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.98 -44.44 59.49 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 127.683 2.393 . . . . 0.0 114.251 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -60.84 -24.12 78.37 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.7 2.933 . . . . 0.0 115.59 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 20' ' ' ALA . 1.7 mp -105.91 -40.02 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.545 1.138 . . . . 0.0 111.763 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.11 139.1 51.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.515 1.526 . . . . 0.0 110.342 -169.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.7 p -63.03 155.83 26.51 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.71 0.404 . . . . 0.0 110.009 173.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -49.45 -51.48 35.35 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.694 -0.629 . . . . 0.0 111.3 176.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.5 t -61.08 -35.59 77.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.238 1.015 . . . . 0.0 112.973 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.09 97.27 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.362 0.983 . . . . 0.0 112.413 173.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -67.3 -47.74 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.774 0.829 . . . . 0.0 110.472 176.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -59.61 -42.84 93.52 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.283 0.492 . . . . 0.0 111.595 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.35 -45.75 93.09 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.66 0.784 . . . . 0.0 112.552 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.1 -33.72 65.04 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 118.883 0.765 . . . . 0.0 112.53 178.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -60.77 -42.16 96.95 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.002 1.401 . . . . 0.0 111.071 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -68.0 -44.58 76.24 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.371 -0.831 . . . . 0.0 112.629 173.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.19 -29.18 67.97 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -174.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -107.14 6.34 28.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.209 1.404 . . . . 0.0 112.836 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 66.66 31.91 7.38 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.719 2.007 . . . . 0.0 114.192 168.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -55.17 129.49 38.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.08 1.752 . . . . 0.0 110.572 174.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.1 t -139.41 179.52 6.49 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.457 1.103 . . . . 0.0 112.727 -169.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.78 137.58 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.162 1.785 . . . . 0.0 109.6 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.6 t -147.5 128.69 14.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.209 1.004 . . . . 0.0 110.39 172.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? 57.28 22.67 7.96 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 125.606 1.563 . . . . 0.0 113.145 -171.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.24 -3.78 86.52 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.802 1.667 . . . . 0.0 114.546 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -92.61 135.93 33.66 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.651 1.18 . . . . 0.0 110.826 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.6 tt -66.62 139.45 57.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.426 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.24 152.21 48.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.94 0.896 . . . . 0.0 112.73 171.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.01 149.04 72.2 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 125.846 1.658 . . . . 0.0 109.872 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.53 145.2 52.01 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.39 2.06 . . . . 0.0 110.62 178.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.7 mt -61.34 132.94 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.971 0.891 . . . . 0.0 111.063 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.27 171.24 42.16 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 126.402 1.954 . . . . 0.0 112.306 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -164.1 158.73 19.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.916 1.687 . . . . 0.0 111.253 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.14 167.04 38.04 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 121.854 0.697 . . . . 0.0 114.341 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -166.11 118.39 1.06 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.359 2.264 . . . . 0.0 108.499 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -77.88 142.9 38.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.39 0.676 . . . . 0.0 111.812 -171.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pp -65.62 -7.87 17.32 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.876 1.27 . . . . 0.0 113.724 170.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' HB3' HG11 ' A' ' 128' ' ' VAL . 22.6 mt -69.5 127.81 34.3 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.001 1.721 . . . . 0.0 110.997 170.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -100.21 84.62 2.86 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.992 1.317 . . . . 0.0 110.784 176.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -71.04 -25.89 62.86 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.27 -17.62 62.7 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.763 1.225 . . . . 0.0 113.732 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -111.66 -0.37 16.07 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.74 1.616 . . . . 0.0 113.189 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.3 p -72.03 167.54 19.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.167 0.987 . . . . 0.0 113.61 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 31.7 p -136.48 141.43 43.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.225 1.41 . . . . 0.0 110.518 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.88 141.95 29.45 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.008 1.323 . . . . 0.0 112.313 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.54 122.51 21.32 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.122 2.169 . . . . 0.0 109.317 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.2 tp -63.81 134.72 55.75 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.377 1.071 . . . . 0.0 111.577 -174.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 36.0 mm -114.33 -39.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 124.857 1.263 . . . . 0.0 112.028 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.1 t -159.77 145.35 15.62 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.455 0.702 . . . . 0.0 111.249 176.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -133.0 106.32 7.59 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.166 1.387 . . . . 0.0 110.199 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -113.53 177.45 4.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.977 2.111 . . . . 0.0 110.877 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.96 -36.68 81.9 Favored Glycine 0 N--CA 1.477 1.393 0 C-N-CA 124.497 1.046 . . . . 0.0 115.376 -169.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.1 m -138.43 13.5 2.78 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 176.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.4 m -140.87 134.71 30.47 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.373 1.869 . . . . 0.0 109.433 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 97.2 mt -140.39 137.45 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.709 1.204 . . . . 0.0 109.404 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -119.88 137.84 53.77 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.063 0.945 . . . . 0.0 111.226 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -125.47 147.24 49.29 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.622 1.969 . . . . 0.0 111.716 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -101.2 126.49 47.93 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 125.207 1.403 . . . . 0.0 107.616 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -98.36 125.46 43.49 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.374 1.47 . . . . 0.0 109.665 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 64.0 m -95.45 107.3 19.45 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 169.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 105' ' ' LEU . 10.0 t -110.25 105.39 57.13 Favored Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 123.519 0.728 . . . . 0.0 110.536 -169.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.79 158.98 43.79 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.41 2.74 . . . . 0.0 111.142 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.4 p -110.68 150.2 29.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.551 0.691 . . . . 0.0 112.462 -174.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.22 -9.99 59.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.222 1.409 . . . . 0.0 112.104 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -79.37 -22.7 44.05 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.044 1.738 . . . . 0.0 112.809 173.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.86 7.25 71.17 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.761 1.172 . . . . 0.0 113.744 -174.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.7 m -75.57 157.16 84.6 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.52 1.128 . . . . 0.0 112.113 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -54.24 148.77 39.57 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 124.184 3.256 . . . . 0.0 113.538 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.0 m -61.47 130.0 43.88 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -174.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.94 137.87 34.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.395 1.478 . . . . 0.0 111.888 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -84.83 133.58 34.32 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.735 0.814 . . . . 0.0 112.047 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -135.85 117.66 15.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.327 1.851 . . . . 0.0 109.236 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -89.02 126.57 35.48 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.3 t -127.9 120.07 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.575 1.55 . . . . 0.0 109.43 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.8 m -108.21 134.83 50.51 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.673 1.189 . . . . 0.0 109.675 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -115.05 141.56 47.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.767 2.027 . . . . 0.0 108.861 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.2 t -133.18 130.78 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.471 1.909 . . . . 0.0 107.789 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -80.62 130.56 35.18 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.451 0.643 . . . . 0.0 111.657 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -151.66 139.81 20.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.767 2.027 . . . . 0.0 108.353 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 27.3 m120 55.77 36.54 27.46 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.918 0.887 . . . . 0.0 112.547 -173.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 59.6 mttp 69.31 18.8 7.94 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.529 1.532 . . . . 0.0 113.78 178.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -145.55 141.53 28.33 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.747 1.619 . . . . 0.0 111.474 -173.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -76.82 123.85 26.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.749 1.22 . . . . 0.0 112.301 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -127.15 155.14 43.84 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.18 1.792 . . . . 0.0 111.686 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.2 t -72.74 133.08 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.186 1.394 . . . . 0.0 110.168 174.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -82.57 5.32 21.29 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -153.36 129.68 10.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.774 1.23 . . . . 0.0 110.387 -174.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.51 -40.72 96.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.321 1.049 . . . . 0.0 113.547 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -99.48 18.56 17.54 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.079 1.752 . . . . 0.0 113.168 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.68 -29.5 68.12 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.898 0.879 . . . . 0.0 113.097 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 65.1 t -141.16 120.27 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 126.088 1.755 . . . . 0.0 109.266 -173.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.405 HG21 ' CE2' ' A' ' 24' ' ' PHE . 1.8 pt . . . . . 0 C--O 1.25 1.09 0 C-N-CA 125.105 1.362 . . . . 0.0 113.084 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.877 -0.489 . . . . 0.0 111.877 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt 61.82 17.02 8.45 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 126.366 1.867 . . . . 0.0 115.065 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -145.6 141.09 27.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.127 1.771 . . . . 0.0 110.826 -172.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -161.73 43.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 125.498 1.519 . . . . 0.0 111.632 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 t -153.61 162.19 41.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.664 1.185 . . . . 0.0 111.706 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.01 -156.33 26.77 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.008 1.766 . . . . 0.0 112.239 -172.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -160.25 -45.36 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.35 1.06 . . . . 0.0 112.294 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tt -82.7 143.29 31.02 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.44 1.096 . . . . 0.0 108.972 168.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 t -136.66 169.33 17.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.585 1.554 . . . . 0.0 111.331 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -53.41 -43.42 67.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.747 1.219 . . . . 0.0 113.184 -171.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -59.79 -46.36 89.45 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.761 0.825 . . . . 0.0 112.129 176.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -66.4 -47.82 72.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.762 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.81 -47.88 76.39 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.635 1.107 . . . . 0.0 111.792 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.69 -46.62 77.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.057 1.343 . . . . 0.0 111.901 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -71.31 -41.82 69.4 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.209 -0.932 . . . . 0.0 112.102 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.2 mt -55.1 -41.3 71.46 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.072 0.949 . . . . 0.0 110.878 172.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -50.04 68.53 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.308 1.043 . . . . 0.0 111.702 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.48 -43.42 88.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.626 . . . . 0.0 112.244 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.0 t -66.57 -34.98 79.11 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.714 0.406 . . . . 0.0 111.946 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -38.99 81.64 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.033 -1.042 . . . . 0.0 112.614 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -44.09 96.77 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.834 0.743 . . . . 0.0 111.142 169.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.63 -49.47 76.41 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.545 0.738 . . . . 0.0 111.903 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -66.3 -37.9 86.48 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.133 -0.979 . . . . 0.0 112.98 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.58 -58.71 7.05 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.961 0.904 . . . . 0.0 110.714 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -66.98 -28.82 68.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -175.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.1 -50.97 69.8 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.683 0.674 . . . . 0.0 110.628 169.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 35.6 m -60.09 -46.6 89.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.911 0.884 . . . . 0.0 111.556 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.8 mmm -65.35 -15.17 62.29 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -84.82 -9.39 58.2 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.429 1.092 . . . . 0.0 113.001 172.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.86 2.98 64.38 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.454 1.502 . . . . 0.0 115.174 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -159.08 148.65 18.84 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 113.215 -170.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -92.28 102.52 6.59 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.21 1.004 . . . . 0.0 110.969 171.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.55 -9.38 22.28 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 124.296 3.331 . . . . 0.0 114.471 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -65.54 -23.93 66.99 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.148 0.885 . . . . 0.0 112.467 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.5 t -97.01 125.77 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.376 1.87 . . . . 0.0 108.41 173.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -101.3 -5.56 25.29 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -169.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -135.41 23.74 3.46 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.372 1.469 . . . . 0.0 113.903 -169.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.2 140.46 58.87 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.213 -0.93 . . . . 0.0 111.45 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.7 t -87.71 143.61 10.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.756 1.622 . . . . 0.0 107.795 171.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -151.85 125.11 4.19 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.181 -0.914 . . . . 0.0 112.517 -170.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -56.96 132.91 54.57 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.622 2.881 . . . . 0.0 112.188 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 m -83.14 -3.65 57.56 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.11 169.51 28.08 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.774 1.654 . . . . 0.0 113.931 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -140.27 166.87 23.52 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.672 1.989 . . . . 0.0 110.151 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -145.4 -177.54 5.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.999 0.92 . . . . 0.0 111.929 177.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -128.21 131.01 48.85 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.548 1.139 . . . . 0.0 110.565 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -156.51 135.61 11.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.786 1.635 . . . . 0.0 110.42 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 53.73 30.82 11.76 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.645 1.178 . . . . 0.0 112.939 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 73.01 14.59 4.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.341 2.256 . . . . 0.0 114.49 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.7 mt -116.97 154.78 30.29 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.832 1.653 . . . . 0.0 110.562 178.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -86.55 126.78 34.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 169.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -103.95 142.45 34.4 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.899 1.679 . . . . 0.0 113.06 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -117.08 137.14 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.489 1.515 . . . . 0.0 109.39 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -70.71 144.65 50.91 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.727 0.811 . . . . 0.0 111.925 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 39.3 mmm -78.99 148.87 32.41 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.098 0.559 . . . . 0.0 111.71 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 18.1 m -79.71 160.96 26.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.216 0.606 . . . . 0.0 111.376 174.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.4 m -31.33 -49.02 0.14 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 -169.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.41 -11.01 60.33 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.672 1.124 . . . . 0.0 114.002 -174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.75 17.08 7.45 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.039 2.136 . . . . 0.0 110.716 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.35 -18.27 62.88 Favored Glycine 0 N--CA 1.474 1.183 0 C-N-CA 125.395 1.474 . . . . 0.0 116.676 -167.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 16.3 p -137.79 164.08 29.78 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.554 1.541 . . . . 0.0 109.431 172.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 tptt -47.98 -50.29 27.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.629 0.772 . . . . 0.0 111.734 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.09 -48.21 80.85 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.799 0.839 . . . . 0.0 112.307 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -59.07 -40.38 84.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.375 0.989 . . . . 0.0 113.316 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.53 -39.73 70.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.48 -43.61 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 118.326 0.512 . . . . 0.0 110.556 172.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -62.72 -30.3 71.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.682 1.193 . . . . 0.0 113.946 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -70.95 -36.13 72.46 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.116 0.871 . . . . 0.0 112.429 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -87.29 -25.68 23.81 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.582 1.153 . . . . 0.0 113.728 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.88 -44.6 59.14 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 127.791 2.436 . . . . 0.0 114.13 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.37 -24.53 77.92 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.79 2.994 . . . . 0.0 115.56 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -110.2 -35.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 112.789 -172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -121.2 141.03 51.24 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.255 1.422 . . . . 0.0 110.016 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.0 p -62.65 151.74 37.27 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -51.1 -46.42 61.83 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.6 m -63.92 -41.49 97.65 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.943 1.697 . . . . 0.0 113.152 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 -32.98 70.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.836 1.198 . . . . 0.0 112.849 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 56.4 mt -70.98 -48.69 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 123.762 0.825 . . . . 0.0 109.989 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.36 -39.93 84.81 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.696 0.284 . . . . 0.0 111.721 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -61.39 -45.57 93.81 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.987 0.915 . . . . 0.0 112.283 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.81 -33.2 66.37 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.876 0.762 . . . . 0.0 112.457 177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -62.3 -41.6 98.65 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.342 1.571 . . . . 0.0 110.965 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -68.9 -41.58 78.06 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.261 -0.9 . . . . 0.0 112.795 172.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.6 -29.23 67.71 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -106.27 9.63 31.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.141 1.377 . . . . 0.0 113.105 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 65.57 30.49 10.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.929 1.692 . . . . 0.0 112.915 169.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -55.8 131.37 46.65 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.314 1.446 . . . . 0.0 110.24 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.9 t -134.32 178.52 6.91 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.536 1.135 . . . . 0.0 111.814 -170.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.1 t -136.64 131.61 47.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 125.876 1.671 . . . . 0.0 108.161 177.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.8 t -136.07 121.66 19.56 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.018 1.327 . . . . 0.0 109.755 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? 51.13 40.79 26.64 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.706 1.202 . . . . 0.0 112.033 -173.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.06 -7.82 54.21 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.771 2.129 . . . . 0.0 115.725 179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -99.25 136.1 39.7 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.171 1.389 . . . . 0.0 111.438 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.42 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.8 tt -64.95 142.27 58.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.161 0.984 . . . . 0.0 109.385 176.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.42 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.93 154.87 45.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.887 0.875 . . . . 0.0 112.467 169.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.86 151.41 72.27 Favored Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.585 . . . . 0.0 110.515 -176.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.04 146.52 47.01 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.446 2.097 . . . . 0.0 111.383 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.5 mt -66.34 134.11 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.181 0.993 . . . . 0.0 111.345 177.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.31 151.06 22.98 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 126.415 1.959 . . . . 0.0 111.583 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -75.44 -35.78 60.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -175.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 78.21 171.9 39.05 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.667 1.603 . . . . 0.0 115.782 170.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 t0 73.19 159.81 0.22 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.705 2.802 . . . . 0.0 113.227 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -127.68 156.27 42.62 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.877 1.671 . . . . 0.0 111.908 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -2.97 14.33 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 170.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 128' ' ' VAL . 50.1 mt -72.1 117.48 13.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.052 1.741 . . . . 0.0 110.299 177.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -89.39 80.52 6.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.222 1.009 . . . . 0.0 110.562 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -68.24 -27.13 66.09 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.351 0.661 . . . . 0.0 112.04 -175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -62.6 -17.53 60.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.029 1.332 . . . . 0.0 113.892 173.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -112.59 0.19 15.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.86 1.664 . . . . 0.0 113.145 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.8 p -69.3 165.31 20.9 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.222 1.009 . . . . 0.0 113.299 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 35.4 p -136.69 139.74 42.18 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.863 1.265 . . . . 0.0 111.007 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.98 148.58 22.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.995 1.318 . . . . 0.0 113.25 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -140.14 122.58 16.09 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 127.994 2.517 . . . . 0.0 109.389 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.8 tp -66.41 132.58 48.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.311 0.959 . . . . 0.0 110.845 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.3 mm -110.65 -42.43 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.434 1.493 . . . . 0.0 112.195 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.9 t -161.08 140.93 10.78 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.849 -0.532 . . . . 0.0 111.681 -170.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -131.96 110.62 10.9 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.495 1.518 . . . . 0.0 109.038 -175.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -131.81 62.16 1.64 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.478 1.911 . . . . 0.0 111.075 -167.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 66.5 -108.03 2.23 Favored Glycine 0 N--CA 1.471 1.033 0 C-N-CA 124.07 0.843 . . . . 0.0 111.826 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.6 m -85.73 8.02 21.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.3 m -128.42 134.71 48.85 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.418 1.887 . . . . 0.0 109.441 177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 76.6 mt -142.43 137.15 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.876 1.27 . . . . 0.0 109.909 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.3 m -115.16 135.45 54.17 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.908 1.283 . . . . 0.0 110.968 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.26 149.98 44.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.117 1.767 . . . . 0.0 111.938 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -101.7 148.56 25.12 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.157 1.783 . . . . 0.0 108.498 168.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -130.11 123.16 29.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.624 1.97 . . . . 0.0 109.365 -174.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 91.7 m -97.39 115.68 28.17 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.454 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.1 t -115.56 105.16 52.4 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 123.835 0.854 . . . . 0.0 110.181 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -65.25 161.23 38.52 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.316 2.677 . . . . 0.0 110.956 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.9 p -110.77 150.58 28.88 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.487 0.66 . . . . 0.0 112.583 -175.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.66 -11.36 59.99 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.046 1.339 . . . . 0.0 112.436 169.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -80.75 -22.37 40.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.909 1.683 . . . . 0.0 112.937 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.81 7.67 74.3 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.667 1.127 . . . . 0.0 113.722 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 m -74.3 157.33 86.67 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.464 1.106 . . . . 0.0 112.068 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.78 146.45 45.32 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 124.242 3.295 . . . . 0.0 113.496 177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.0 m -62.15 130.73 46.79 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.407 1.083 . . . . 0.0 113.878 -173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.71 136.02 36.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.095 1.358 . . . . 0.0 111.36 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -93.89 136.46 34.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.065 0.946 . . . . 0.0 111.778 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -136.99 152.44 50.15 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 127.547 2.339 . . . . 0.0 109.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.66 133.83 53.09 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.321 1.048 . . . . 0.0 111.096 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.13 121.46 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.518 1.527 . . . . 0.0 109.645 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 92.1 m -107.62 127.96 54.12 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.705 1.202 . . . . 0.0 109.937 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -106.12 140.92 38.33 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.458 1.903 . . . . 0.0 109.121 178.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 70.0 t -134.12 127.45 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.463 1.905 . . . . 0.0 107.715 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -77.97 128.63 34.2 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.514 0.673 . . . . 0.0 111.663 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -150.21 138.52 20.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.904 2.081 . . . . 0.0 108.104 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 29.4 m120 54.78 36.0 25.39 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.897 0.879 . . . . 0.0 112.72 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 69.53 15.18 8.29 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.802 1.641 . . . . 0.0 113.984 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -136.98 139.77 41.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.033 1.733 . . . . 0.0 111.522 -174.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -74.81 120.84 20.91 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.222 -0.924 . . . . 0.0 111.744 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -121.36 156.02 33.52 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.019 1.728 . . . . 0.0 112.067 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 6.3 t -79.0 133.13 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.655 1.182 . . . . 0.0 110.267 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -81.75 8.76 9.26 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -154.74 131.22 10.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.04 1.336 . . . . 0.0 109.901 -175.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -67.56 -46.72 71.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.838 0.855 . . . . 0.0 112.891 -175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.54 14.87 7.44 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.243 1.417 . . . . 0.0 113.377 -178.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.52 -32.34 72.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.124 0.97 . . . . 0.0 113.214 -175.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 47.8 t -144.52 117.27 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 C-N-CA 125.754 1.622 . . . . 0.0 108.892 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 pt . . . . . 0 C--O 1.25 1.109 0 O-C-N 125.128 1.517 . . . . 0.0 112.084 -174.513 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -158.41 165.36 34.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.606 1.562 . . . . 0.0 112.571 -178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -148.71 30.22 0.82 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.629 1.171 . . . . 0.0 113.025 -174.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.4 t -164.1 150.38 11.22 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.285 1.834 . . . . 0.0 110.562 -176.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.2 p -93.81 -3.83 51.3 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.259 1.424 . . . . 0.0 113.429 172.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 132.08 -176.27 19.38 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.713 1.625 . . . . 0.0 113.579 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 59.15 -118.25 0.93 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.702 1.601 . . . . 0.0 111.595 -174.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tt -83.63 126.31 32.71 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.516 1.126 . . . . 0.0 111.009 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 98.9 p -108.41 170.92 7.72 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.508 2.323 . . . . 0.0 113.247 -177.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -57.23 -41.3 79.28 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.009 -1.057 . . . . 0.0 112.098 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -64.94 -47.1 78.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.382 0.673 . . . . 0.0 112.029 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -57.02 -54.5 46.04 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.952 0.901 . . . . 0.0 110.782 175.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.1 -47.58 77.78 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.493 0.717 . . . . 0.0 111.762 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.4 -48.94 68.23 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.818 1.247 . . . . 0.0 111.864 175.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -72.65 -41.0 65.93 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.603 -0.686 . . . . 0.0 111.902 -176.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.34 -41.43 72.46 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.951 0.9 . . . . 0.0 110.94 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.11 -48.65 72.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.149 0.98 . . . . 0.0 111.987 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.08 -44.18 94.96 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.368 0.667 . . . . 0.0 112.042 176.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.2 t -66.01 -38.28 88.05 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 122.117 -0.365 . . . . 0.0 111.794 177.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.02 92.64 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.931 -1.105 . . . . 0.0 112.799 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -41.49 97.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.574 0.625 . . . . 0.0 111.561 172.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.61 -47.65 84.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.825 0.85 . . . . 0.0 111.566 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -64.34 -43.09 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.349 -0.844 . . . . 0.0 112.642 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' A' ' 159' ' ' ILE . 48.1 t80 -61.63 -53.36 57.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.072 0.949 . . . . 0.0 111.611 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 18.9 m95 -65.21 -35.84 82.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -68.06 -30.95 70.27 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.12 0.873 . . . . 0.0 112.734 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 50.4 m -72.49 -44.97 61.54 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.45 -0.781 . . . . 0.0 110.875 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.4 mmt -59.98 -26.89 66.38 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.624 1.17 . . . . 0.0 112.997 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.0 m -78.62 -7.08 57.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.796 1.638 . . . . 0.0 113.7 174.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.401 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.46 8.51 87.09 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.53 1.538 . . . . 0.0 115.282 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -168.56 131.4 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.826 1.65 . . . . 0.0 112.714 -169.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -79.96 110.9 17.82 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.275 1.03 . . . . 0.0 110.971 169.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -62.85 -13.62 35.74 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.376 3.384 . . . . 0.0 114.075 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -66.6 -17.36 64.79 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -93.99 121.11 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 125.499 1.519 . . . . 0.0 108.451 171.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -87.74 -13.91 41.17 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.218 1.007 . . . . 0.0 113.405 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -153.7 114.3 4.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.816 2.046 . . . . 0.0 109.311 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.26 137.82 47.65 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.856 1.662 . . . . 0.0 108.971 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.16 124.83 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -146.94 118.09 4.66 Favored Pre-proline 0 CA--C 1.543 0.69 0 CA-C-O 118.489 -0.767 . . . . 0.0 112.68 -168.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -58.61 137.39 79.92 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.608 2.872 . . . . 0.0 112.377 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 57.3 p -86.94 -3.55 59.09 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 173.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.84 167.19 33.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.923 1.725 . . . . 0.0 113.545 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.0 p -143.14 170.16 16.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.722 2.009 . . . . 0.0 110.398 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -145.57 177.5 8.83 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.981 0.912 . . . . 0.0 112.004 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -123.64 131.35 53.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.708 1.203 . . . . 0.0 110.695 -177.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -158.24 137.02 11.27 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.861 1.665 . . . . 0.0 110.601 -175.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 54.34 27.95 8.74 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.659 1.184 . . . . 0.0 112.989 -176.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 68.94 19.11 8.32 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.285 1.834 . . . . 0.0 113.654 -176.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.0 mt -116.34 156.91 25.85 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.14 1.776 . . . . 0.0 110.251 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -89.97 129.77 36.26 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 169.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -107.44 143.73 35.38 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.832 1.653 . . . . 0.0 112.428 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 m -116.02 137.17 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.931 1.292 . . . . 0.0 109.318 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -72.36 139.87 48.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.408 0.683 . . . . 0.0 111.791 173.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.401 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 22.9 mmm -71.36 150.13 45.36 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.761 0.824 . . . . 0.0 111.223 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.7 158.65 35.76 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.771 -0.58 . . . . 0.0 110.709 170.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 p -55.02 -19.61 7.37 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -167.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -71.13 -19.96 62.38 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.134 1.773 . . . . 0.0 113.901 172.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.4 mt -130.47 20.52 5.19 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.089 2.556 . . . . 0.0 109.962 173.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.1 -18.66 60.55 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 117.138 1.615 . . . . 0.0 117.138 -166.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -142.32 157.0 45.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.161 1.784 . . . . 0.0 107.783 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -49.25 -48.21 45.94 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.324 1.05 . . . . 0.0 112.851 -173.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.6 -51.6 62.49 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.256 1.023 . . . . 0.0 111.914 175.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -53.82 -41.82 67.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.315 1.046 . . . . 0.0 113.199 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.27 -43.16 58.03 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.0 t -60.42 -40.93 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 118.8 0.727 . . . . 0.0 110.506 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -65.67 -36.33 83.36 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.677 1.591 . . . . 0.0 112.641 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -66.19 -34.36 77.85 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.252 -0.905 . . . . 0.0 112.465 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -88.92 -27.76 20.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.619 1.167 . . . . 0.0 113.624 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.67 -44.87 33.27 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 127.482 2.313 . . . . 0.0 114.427 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -57.42 -26.33 70.63 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.935 3.09 . . . . 0.0 115.465 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 21.1 mm -110.6 -33.12 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.989 1.316 . . . . 0.0 112.723 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -123.73 142.5 51.02 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.698 1.599 . . . . 0.0 110.168 -170.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -64.69 155.23 34.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -51.11 -48.82 61.63 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.528 -0.733 . . . . 0.0 110.954 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.9 m -57.83 -43.01 85.52 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.301 1.44 . . . . 0.0 112.667 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.24 78.78 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.301 0.955 . . . . 0.0 112.191 176.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.5 mt -72.14 -48.41 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.009 0.923 . . . . 0.0 109.961 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.17 -42.11 90.03 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.257 0.481 . . . . 0.0 111.581 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -61.69 -46.48 89.52 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.031 0.932 . . . . 0.0 112.27 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.15 -32.56 65.56 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.684 0.675 . . . . 0.0 112.47 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -62.25 -43.52 98.64 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.141 1.471 . . . . 0.0 110.814 172.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -67.29 -44.26 79.7 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.302 -0.874 . . . . 0.0 112.744 174.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.11 -28.46 67.35 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -174.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -106.92 7.07 29.82 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.191 1.397 . . . . 0.0 112.811 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 67.77 26.54 7.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.824 2.049 . . . . 0.0 114.268 169.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -52.08 132.49 32.97 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.719 1.608 . . . . 0.0 110.586 174.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.2 t -144.35 177.16 8.82 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.239 1.016 . . . . 0.0 111.866 -170.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.9 134.92 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.944 1.698 . . . . 0.0 109.001 -177.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.4 t -140.66 124.81 17.47 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.468 1.107 . . . . 0.0 110.204 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 41.9 tptt 58.33 23.94 11.05 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 125.321 1.449 . . . . 0.0 113.181 -174.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.77 -4.25 86.4 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 126.02 1.771 . . . . 0.0 114.509 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -91.16 129.15 37.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.6 1.2 . . . . 0.0 110.52 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -68.04 142.72 55.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.16 0.984 . . . . 0.0 108.791 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.79 152.04 44.89 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.113 0.965 . . . . 0.0 113.167 174.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 30.6 m -132.4 147.9 67.52 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 125.981 1.712 . . . . 0.0 110.284 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -73.53 145.39 37.56 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.638 2.225 . . . . 0.0 111.108 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.8 mt -68.26 132.37 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.098 0.959 . . . . 0.0 110.189 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -164.16 -172.48 31.69 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.69 1.614 . . . . 0.0 112.522 174.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -141.94 135.75 29.71 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.451 1.501 . . . . 0.0 109.993 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -153.45 141.13 8.07 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.532 1.063 . . . . 0.0 112.814 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -169.75 135.31 1.46 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.913 2.085 . . . . 0.0 109.396 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -113.77 140.2 48.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.209 1.003 . . . . 0.0 111.522 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.61 -2.36 8.85 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.981 1.312 . . . . 0.0 114.076 171.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 55.6 mt -69.61 117.95 11.86 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.193 1.797 . . . . 0.0 110.809 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -92.07 81.79 5.08 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.251 1.02 . . . . 0.0 110.419 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -69.19 -27.28 65.36 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.681 -0.637 . . . . 0.0 112.031 -174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.47 -17.79 60.32 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.881 1.272 . . . . 0.0 113.832 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -111.94 -0.09 15.9 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.746 1.618 . . . . 0.0 113.147 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 28.7 p -70.81 165.82 22.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.134 0.974 . . . . 0.0 113.362 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.7 p -135.47 141.58 45.37 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.926 1.29 . . . . 0.0 110.495 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.85 146.88 24.52 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.034 1.334 . . . . 0.0 111.951 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -142.96 121.6 12.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.402 1.881 . . . . 0.0 109.886 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 53.3 tp -64.76 133.38 51.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.103 0.961 . . . . 0.0 111.407 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.3 mm -110.39 -43.71 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.519 1.128 . . . . 0.0 111.795 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -162.84 137.25 6.39 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.954 -0.467 . . . . 0.0 111.556 -172.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.412 ' HE2' HD13 ' A' ' 122' ' ' ILE . 21.3 ttmt -126.34 105.44 8.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.46 1.504 . . . . 0.0 108.918 -177.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -124.24 62.94 1.09 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.638 1.975 . . . . 0.0 111.503 -166.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 64.43 -109.2 2.68 Favored Glycine 0 N--CA 1.471 0.985 0 O-C-N 121.439 -0.788 . . . . 0.0 111.296 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m -82.07 4.7 21.99 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.4 m -130.79 136.31 48.59 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.345 1.858 . . . . 0.0 109.955 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.412 HD13 ' HE2' ' A' ' 117' ' ' LYS . 96.2 mt -141.12 137.72 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 124.929 1.291 . . . . 0.0 110.186 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.6 m -118.05 137.53 52.84 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.237 . . . . 0.0 111.068 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.8 150.36 47.85 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.81 2.044 . . . . 0.0 111.627 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -101.47 147.63 26.14 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.269 1.828 . . . . 0.0 108.397 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.89 118.07 23.85 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.092 1.757 . . . . 0.0 109.759 -174.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 87.5 m -90.77 110.55 21.75 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 170.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.7 t -112.7 105.36 55.96 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.64 0.776 . . . . 0.0 110.22 -172.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.23 160.64 41.15 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.344 2.696 . . . . 0.0 111.049 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 p -111.53 148.87 32.29 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.464 0.65 . . . . 0.0 112.329 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.8 mt -75.03 -10.51 59.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.913 1.285 . . . . 0.0 112.585 170.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -80.0 -22.2 42.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.845 1.658 . . . . 0.0 112.823 172.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 87.33 7.82 75.72 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 124.652 1.12 . . . . 0.0 113.729 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.9 m -74.03 157.04 87.46 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.434 1.094 . . . . 0.0 112.108 170.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -53.61 145.93 45.84 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 124.229 3.286 . . . . 0.0 113.66 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.8 m -61.87 130.52 46.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.502 1.121 . . . . 0.0 113.814 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.58 132.96 35.7 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.068 1.347 . . . . 0.0 111.217 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.3 119.79 31.64 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.928 0.891 . . . . 0.0 110.709 172.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -117.02 160.87 20.3 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.952 2.501 . . . . 0.0 109.747 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -127.62 140.15 52.28 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.981 -1.074 . . . . 0.0 111.38 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -139.17 125.44 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.505 1.522 . . . . 0.0 110.022 -173.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.9 m -110.69 136.25 50.06 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.787 1.235 . . . . 0.0 109.954 178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -116.97 145.07 43.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.851 2.061 . . . . 0.0 109.048 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 76.0 t -134.4 128.14 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 126.293 1.837 . . . . 0.0 107.986 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.0 ttmt -82.15 110.16 17.11 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.672 0.389 . . . . 0.0 110.072 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -81.27 -22.38 38.69 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -171.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -161.19 -68.35 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.351 1.46 . . . . 0.0 110.829 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -135.93 6.07 3.12 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.526 1.531 . . . . 0.0 112.882 -176.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -146.66 136.71 23.46 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.045 1.738 . . . . 0.0 113.143 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -76.23 124.67 27.83 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.266 1.826 . . . . 0.0 112.38 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -129.45 151.78 49.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.809 1.644 . . . . 0.0 111.752 -175.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.7 t -72.8 133.22 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.02 1.328 . . . . 0.0 110.198 178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -82.34 6.09 18.1 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -155.29 132.65 11.04 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -175.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -67.19 -44.96 78.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.911 0.885 . . . . 0.0 113.309 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -93.18 18.58 9.2 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.288 1.835 . . . . 0.0 113.15 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.8 -26.75 64.4 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.204 1.002 . . . . 0.0 113.316 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 21.2 t -146.99 127.22 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 127.033 2.133 . . . . 0.0 108.229 -174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.427 HG21 ' CE1' ' A' ' 24' ' ' PHE . 1.3 pt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 112.471 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.531 0 N-CA-C 111.426 -0.669 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -84.35 -4.43 58.88 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -174.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -157.03 151.52 25.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.614 1.566 . . . . 0.0 111.417 -176.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 t -164.82 -179.62 5.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.631 1.972 . . . . 0.0 110.706 -175.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.0 t -153.56 133.41 13.14 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.432 1.493 . . . . 0.0 110.891 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.19 -123.24 5.96 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.186 0.898 . . . . 0.0 111.079 -170.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -161.92 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.059 1.344 . . . . 0.0 112.086 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -85.78 137.97 32.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.88 1.272 . . . . 0.0 109.637 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -132.55 172.08 12.96 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.674 1.59 . . . . 0.0 111.866 178.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -52.84 -44.85 67.04 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.096 1.358 . . . . 0.0 113.613 -169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.3 -45.91 92.51 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.369 0.668 . . . . 0.0 112.056 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -64.23 -47.68 78.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.794 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.81 -47.93 79.15 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.557 1.072 . . . . 0.0 111.85 175.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.18 -47.33 72.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.201 1.4 . . . . 0.0 111.996 174.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.7 -41.19 68.91 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.31 -0.869 . . . . 0.0 112.056 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.74 -40.25 72.27 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.857 0.863 . . . . 0.0 111.244 172.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -47.88 76.72 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.093 0.957 . . . . 0.0 111.885 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.7 -39.31 94.0 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.548 -0.72 . . . . 0.0 112.48 176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -66.92 -35.22 79.51 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.737 -0.602 . . . . 0.0 111.63 174.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.22 -34.47 76.31 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.828 -1.17 . . . . 0.0 112.528 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -58.64 -49.99 75.5 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.877 0.762 . . . . 0.0 110.377 169.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -59.74 -51.1 71.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.458 1.103 . . . . 0.0 111.327 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -69.0 -32.5 72.09 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.193 -0.942 . . . . 0.0 113.286 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -63.3 -57.68 9.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.837 0.744 . . . . 0.0 110.647 172.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -66.57 -32.89 74.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.14 -16.04 63.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 172.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 44.4 m -91.06 -52.28 4.92 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.396 1.079 . . . . 0.0 110.334 171.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 86.9 mmm -62.24 -17.73 59.18 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.9 t -77.04 -10.61 59.49 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.352 1.061 . . . . 0.0 113.57 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.95 1.35 82.41 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.257 1.408 . . . . 0.0 114.544 -177.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -171.0 132.87 0.86 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.043 2.137 . . . . 0.0 111.225 -169.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -82.26 109.61 16.68 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.705 0.802 . . . . 0.0 110.845 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -62.12 -14.88 40.43 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.045 3.164 . . . . 0.0 114.248 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -68.54 -22.35 64.51 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.299 0.954 . . . . 0.0 113.431 171.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -78.62 118.75 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.81 1.244 . . . . 0.0 108.594 174.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -73.8 -28.08 61.45 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -172.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -142.81 116.3 9.11 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.414 1.886 . . . . 0.0 110.64 178.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -134.41 141.08 46.71 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.738 1.615 . . . . 0.0 109.167 174.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.46 113.31 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.7 m -109.36 113.84 58.08 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.365 1.066 . . . . 0.0 111.667 -173.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 139.82 31.04 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.123 2.549 . . . . 0.0 110.449 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.9 p -93.43 -1.28 55.93 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -84.84 157.03 31.97 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.164 1.364 . . . . 0.0 113.823 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -141.15 166.82 23.73 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.747 2.019 . . . . 0.0 110.122 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -149.53 178.23 9.01 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.278 1.031 . . . . 0.0 111.814 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -124.03 131.04 53.51 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.614 1.166 . . . . 0.0 110.711 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -157.26 135.14 10.86 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.971 1.708 . . . . 0.0 110.273 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 56.12 28.42 12.98 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.519 1.128 . . . . 0.0 112.862 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 70.47 15.45 7.24 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.915 2.086 . . . . 0.0 114.171 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.0 mt -113.75 153.17 29.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.021 1.729 . . . . 0.0 110.152 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -88.16 128.55 35.44 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 168.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.77 143.31 34.1 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.649 1.58 . . . . 0.0 112.228 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -115.9 134.67 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.929 1.292 . . . . 0.0 109.119 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.67 141.27 46.46 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.579 172.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.4 mmm -76.87 152.41 35.44 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.076 0.55 . . . . 0.0 111.717 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -71.94 165.16 24.76 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.542 -0.724 . . . . 0.0 111.067 169.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.7 p -57.91 -18.43 22.94 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -168.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -71.54 -21.4 61.9 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.089 1.756 . . . . 0.0 114.046 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 80.0 mt -131.77 19.63 4.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.357 2.263 . . . . 0.0 110.108 177.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.57 -17.11 56.69 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 125.665 1.602 . . . . 0.0 116.725 -167.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.0 m -139.33 153.22 47.68 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.132 1.773 . . . . 0.0 107.862 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 mmmm -49.07 -45.62 43.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.106 0.963 . . . . 0.0 112.02 -177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.88 -44.8 82.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.318 1.047 . . . . 0.0 113.266 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -59.19 -40.77 86.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.457 1.103 . . . . 0.0 112.852 175.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.02 -41.02 71.42 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 87.9 t -59.37 -44.12 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 CA-C-N 118.424 0.557 . . . . 0.0 110.478 171.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -63.6 -30.51 71.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.925 1.29 . . . . 0.0 113.946 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -73.13 -35.91 66.59 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.166 0.894 . . . . 0.0 112.366 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 -27.59 28.05 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.452 1.101 . . . . 0.0 113.631 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.88 -45.85 38.6 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 127.668 2.387 . . . . 0.0 114.311 -177.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -57.38 -26.53 71.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.986 3.124 . . . . 0.0 115.592 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 mm -111.56 -31.85 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.78 1.232 . . . . 0.0 112.898 -172.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -124.23 140.55 52.85 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.309 1.443 . . . . 0.0 110.182 -170.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.5 p -63.67 157.37 24.21 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.184 0.594 . . . . 0.0 109.891 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -50.17 -50.86 47.8 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.47 -0.769 . . . . 0.0 110.926 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.1 m -59.48 -41.14 89.12 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.683 1.193 . . . . 0.0 112.525 179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.29 -36.98 79.1 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.426 1.012 . . . . 0.0 112.165 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.7 mt -73.31 -47.72 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 123.998 0.919 . . . . 0.0 110.089 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.17 -41.54 88.68 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.088 0.404 . . . . 0.0 111.509 176.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -46.02 91.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.986 0.914 . . . . 0.0 112.091 175.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -69.45 -34.79 74.51 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-N 119.32 0.964 . . . . 0.0 112.435 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -62.25 -40.28 95.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.929 1.364 . . . . 0.0 111.11 173.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -69.37 -42.71 74.83 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.397 -0.814 . . . . 0.0 112.578 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.68 -30.75 70.36 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -108.44 6.93 26.69 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.358 1.463 . . . . 0.0 112.949 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 67.21 31.72 6.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.507 1.923 . . . . 0.0 114.248 168.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -53.46 119.29 4.65 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.959 1.704 . . . . 0.0 110.684 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.6 t -129.93 178.28 6.65 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.518 1.127 . . . . 0.0 112.256 -168.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.0 t -136.41 135.06 49.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 126.047 1.739 . . . . 0.0 109.277 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.5 t -145.07 129.54 17.91 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.087 0.955 . . . . 0.0 109.991 171.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.3 tptt 57.66 22.21 8.08 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.141 1.376 . . . . 0.0 113.236 -173.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.54 -4.81 85.83 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 126.017 1.77 . . . . 0.0 114.745 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -90.41 137.0 32.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.763 1.282 . . . . 0.0 110.932 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -66.74 140.56 57.87 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.762 0.825 . . . . 0.0 108.827 171.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.456 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.38 152.63 48.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.015 0.926 . . . . 0.0 112.824 169.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.1 m -134.08 149.22 70.92 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.711 1.604 . . . . 0.0 110.17 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 146.48 33.08 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.732 2.288 . . . . 0.0 111.368 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.8 mt -68.56 131.41 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.076 0.95 . . . . 0.0 110.032 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.01 47.69 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.445 1.497 . . . . 0.0 113.063 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -157.71 140.16 14.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.191 1.396 . . . . 0.0 111.114 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -139.42 30.76 2.39 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.267 1.413 . . . . 0.0 113.243 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.62 126.13 26.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.299 1.039 . . . . 0.0 112.021 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -102.82 139.87 37.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.355 1.062 . . . . 0.0 112.534 -172.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.44 1.13 2.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.831 1.652 . . . . 0.0 114.302 169.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.451 ' HB3' HG11 ' A' ' 128' ' ' VAL . 69.3 mt -68.99 122.28 18.36 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.376 1.87 . . . . 0.0 110.598 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -95.41 77.87 3.4 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.957 1.303 . . . . 0.0 110.277 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -66.94 -27.37 67.42 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.721 0.808 . . . . 0.0 111.916 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.15 -17.76 54.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.166 1.386 . . . . 0.0 113.876 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.2 0.1 14.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.036 1.734 . . . . 0.0 113.032 175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 46.4 p -69.91 167.19 17.92 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 36.8 p -136.2 141.17 43.99 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.982 1.313 . . . . 0.0 110.806 177.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 141.95 29.01 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.03 1.332 . . . . 0.0 112.039 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -138.76 121.81 16.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 127.032 2.133 . . . . 0.0 109.358 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.6 tp -64.19 137.58 58.02 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.106 0.962 . . . . 0.0 112.22 -170.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.5 mm -119.2 -38.5 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.284 1.434 . . . . 0.0 112.269 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 16.6 t -157.69 143.02 17.01 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.713 0.805 . . . . 0.0 110.468 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -143.98 96.9 2.97 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.67 1.188 . . . . 0.0 108.849 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -137.7 89.2 2.39 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.772 1.229 . . . . 0.0 111.96 -168.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.48 -119.82 19.96 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.065 0.84 . . . . 0.0 111.528 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.8 m -80.12 6.22 12.22 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -178.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 27.9 m -131.33 134.75 46.64 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.075 1.75 . . . . 0.0 110.539 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 98.5 mt -140.62 138.81 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.334 1.454 . . . . 0.0 109.427 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.0 m -121.42 137.65 54.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.113 1.365 . . . . 0.0 111.357 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -126.34 147.88 49.66 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.408 1.883 . . . . 0.0 112.09 173.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -96.87 139.6 32.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 126.382 1.873 . . . . 0.0 107.311 168.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -115.32 122.47 46.01 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.944 1.698 . . . . 0.0 109.778 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 57.6 m -96.0 110.47 22.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG11 ' HB3' ' A' ' 105' ' ' LEU . 12.8 t -113.57 105.82 54.61 Favored Pre-proline 0 N--CA 1.469 0.491 0 C-N-CA 123.471 0.708 . . . . 0.0 110.496 -169.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.53 161.03 36.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.388 2.725 . . . . 0.0 111.181 174.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 p -109.77 153.16 24.75 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.385 0.674 . . . . 0.0 112.436 -176.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 97.6 mt -79.6 -5.94 56.05 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.233 1.413 . . . . 0.0 113.106 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.74 -7.05 26.04 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.333 1.453 . . . . 0.0 113.187 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.16 7.21 70.37 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.031 1.301 . . . . 0.0 114.455 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 74.6 m -75.25 155.11 86.2 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.784 1.234 . . . . 0.0 112.12 173.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.12 146.59 48.09 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.137 3.225 . . . . 0.0 113.383 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.18 130.23 45.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.52 1.128 . . . . 0.0 113.941 -174.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -81.71 138.27 35.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.385 1.474 . . . . 0.0 111.946 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -86.66 135.16 33.51 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 169.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.74 158.75 40.35 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 128.022 2.529 . . . . 0.0 109.232 170.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -128.07 135.15 49.44 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.3 1.04 . . . . 0.0 111.275 173.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.11 122.64 26.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.297 1.439 . . . . 0.0 109.314 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.0 m -110.21 131.23 55.24 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.728 1.211 . . . . 0.0 109.858 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -110.64 138.38 47.1 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.756 2.022 . . . . 0.0 108.799 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 91.3 t -132.2 126.22 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.904 1.682 . . . . 0.0 108.234 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -80.19 107.33 12.9 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.962 -0.461 . . . . 0.0 110.506 175.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -91.39 -49.35 6.39 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.2 0.6 . . . . 0.0 112.28 -169.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -149.1 79.39 1.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.514 1.526 . . . . 0.0 109.819 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 65.28 9.93 6.05 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.254 1.821 . . . . 0.0 114.564 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -148.14 134.32 19.38 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.964 1.706 . . . . 0.0 112.938 -175.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -76.11 123.4 25.75 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.907 1.683 . . . . 0.0 111.887 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -127.84 151.77 48.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.562 1.545 . . . . 0.0 111.791 -177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 15.4 t -74.43 132.69 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.81 1.244 . . . . 0.0 109.883 176.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -80.34 7.81 8.83 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -154.48 130.22 10.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.267 1.427 . . . . 0.0 110.107 -175.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.31 -47.8 75.32 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.92 0.888 . . . . 0.0 112.863 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -87.97 17.35 5.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.261 1.424 . . . . 0.0 113.46 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.57 70.61 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.148 0.979 . . . . 0.0 113.424 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.7 t -147.07 113.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.78 1.632 . . . . 0.0 109.151 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.4 pt . . . . . 0 C--O 1.252 1.188 0 O-C-N 124.823 1.327 . . . . 0.0 113.484 -173.417 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.939 -0.464 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -156.6 140.38 16.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.408 1.483 . . . . 0.0 111.543 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.58 142.39 12.46 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.56 1.544 . . . . 0.0 111.202 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.7 m -142.93 136.99 29.13 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.73 1.612 . . . . 0.0 109.605 -174.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.4 p -160.94 131.82 5.38 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.753 1.221 . . . . 0.0 111.434 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.45 -9.76 57.52 Favored Glycine 0 N--CA 1.475 1.242 0 C-N-CA 124.55 1.072 . . . . 0.0 114.605 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -95.86 168.09 10.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.286 1.835 . . . . 0.0 113.04 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tt -98.27 131.51 44.54 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.552 1.541 . . . . 0.0 111.299 -169.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -108.98 171.2 7.58 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.714 2.006 . . . . 0.0 113.865 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -57.81 -43.46 85.7 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.515 -1.366 . . . . 0.0 113.109 -174.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.01 -45.8 84.05 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.303 0.641 . . . . 0.0 112.057 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -56.03 -54.74 41.26 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.532 1.133 . . . . 0.0 110.441 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.23 -48.03 74.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.764 0.711 . . . . 0.0 111.784 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.77 -47.83 73.41 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.988 1.315 . . . . 0.0 112.068 176.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -72.19 -41.59 66.81 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.515 -0.741 . . . . 0.0 111.91 -178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -55.65 -39.93 71.55 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.999 0.92 . . . . 0.0 110.85 172.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.57 -48.81 71.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.327 1.051 . . . . 0.0 112.195 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.78 -42.01 98.45 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.525 0.73 . . . . 0.0 112.122 175.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.1 t -67.16 -34.95 78.65 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.82 -0.55 . . . . 0.0 111.604 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.36 70.5 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.907 -1.12 . . . . 0.0 112.793 171.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -58.77 -51.1 71.42 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.951 0.796 . . . . 0.0 110.055 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.7 -55.24 37.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.223 1.409 . . . . 0.0 111.442 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -69.08 -24.91 64.21 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -70.67 -58.24 3.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.107 0.867 . . . . 0.0 110.438 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.31 -40.64 94.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -173.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.2 p30 -74.63 -26.73 60.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 92.1 m -70.06 -46.08 65.71 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.647 0.779 . . . . 0.0 110.815 170.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 80.8 mmm -62.27 -23.5 66.74 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -77.62 -11.95 59.92 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.456 1.102 . . . . 0.0 113.566 172.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.65 9.51 78.29 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 125.472 1.51 . . . . 0.0 115.263 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -166.34 127.16 1.72 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.575 1.55 . . . . 0.0 112.563 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -81.93 123.17 80.25 Favored Pre-proline 0 CA--C 1.553 1.083 0 O-C-N 121.448 -0.783 . . . . 0.0 112.588 170.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.29 -9.34 17.19 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.074 2.516 . . . . 0.0 112.683 172.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -59.32 -21.19 59.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.948 1.699 . . . . 0.0 113.563 168.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -119.86 126.16 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.286 1.834 . . . . 0.0 109.105 -178.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -100.9 -7.47 23.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.155 1.168 . . . . 0.0 114.155 -171.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -134.65 23.25 3.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.461 1.505 . . . . 0.0 113.566 -169.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.96 145.59 55.58 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.031 0.932 . . . . 0.0 111.992 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.37 118.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 124.802 1.241 . . . . 0.0 108.026 172.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -106.7 117.82 55.88 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.672 1.189 . . . . 0.0 110.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -60.06 151.42 72.59 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.431 2.754 . . . . 0.0 112.433 176.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.3 t -97.83 142.94 28.97 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.902 0.881 . . . . 0.0 112.009 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.23 -173.15 46.11 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 124.805 1.193 . . . . 0.0 114.1 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -146.88 173.41 12.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 127.068 2.147 . . . . 0.0 110.305 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -142.7 177.71 8.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.907 0.883 . . . . 0.0 111.955 173.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -126.55 131.86 51.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.719 1.208 . . . . 0.0 110.586 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -158.41 136.36 10.58 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.842 1.657 . . . . 0.0 110.524 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 54.62 28.95 10.64 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.651 1.18 . . . . 0.0 113.028 -177.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.38 19.91 7.49 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.255 1.822 . . . . 0.0 113.68 -177.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 mt -118.81 155.58 30.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.139 1.776 . . . . 0.0 110.202 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -89.74 127.67 35.99 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -105.54 143.73 33.29 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.782 1.633 . . . . 0.0 112.598 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -116.81 137.04 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.121 1.368 . . . . 0.0 108.999 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -72.33 144.53 48.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.977 0.511 . . . . 0.0 111.73 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 32.5 mmm -75.26 148.3 39.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.288 0.635 . . . . 0.0 110.806 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.5 162.0 29.58 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.694 -0.629 . . . . 0.0 110.264 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -56.43 -20.93 22.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.66 -24.31 67.56 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.772 2.029 . . . . 0.0 114.555 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.1 mt -133.21 21.49 4.06 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.571 2.348 . . . . 0.0 109.844 177.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.03 -15.99 56.92 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 125.487 1.517 . . . . 0.0 116.812 -167.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 6.8 m -142.97 154.19 43.78 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.123 1.769 . . . . 0.0 107.845 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.3 mmmt -49.68 -46.78 50.31 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.049 0.939 . . . . 0.0 112.097 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.33 80.75 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.874 0.869 . . . . 0.0 112.903 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.2 mtpt -57.6 -41.92 82.2 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.634 1.174 . . . . 0.0 112.803 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.36 68.71 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 178.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.07 -44.5 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.382 0.537 . . . . 0.0 110.368 171.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -62.58 -32.75 73.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.947 1.299 . . . . 0.0 114.041 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -73.76 -34.04 64.54 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.234 -0.916 . . . . 0.0 112.619 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.54 -26.4 28.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.359 1.064 . . . . 0.0 113.453 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -44.98 54.03 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 127.467 2.307 . . . . 0.0 114.23 -176.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -60.78 -24.25 78.48 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.726 2.951 . . . . 0.0 115.451 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.5 mm -107.47 -35.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.25 1.02 . . . . 0.0 112.263 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -125.26 138.89 54.1 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.869 1.668 . . . . 0.0 110.233 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 60.7 p -63.37 157.06 24.06 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.633 0.373 . . . . 0.0 110.189 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -43.57 -54.68 4.76 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 122.857 0.463 . . . . 0.0 111.753 172.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.9 m -60.3 -41.79 94.16 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.113 1.365 . . . . 0.0 112.74 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.39 -35.3 75.41 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.161 0.891 . . . . 0.0 112.422 176.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.3 mt -73.17 -48.04 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.004 0.921 . . . . 0.0 109.957 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -58.63 -41.8 86.81 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 118.259 0.482 . . . . 0.0 111.642 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -61.38 -47.35 86.23 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.807 0.843 . . . . 0.0 112.434 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.7 63.19 Favored Glycine 0 CA--C 1.531 1.062 0 CA-C-N 118.771 0.714 . . . . 0.0 112.484 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.69 -42.87 99.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.185 1.493 . . . . 0.0 111.024 171.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -67.41 -45.48 76.0 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.343 -0.848 . . . . 0.0 112.495 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -68.41 -28.51 67.15 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -173.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -107.94 6.18 26.98 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.299 1.44 . . . . 0.0 112.924 177.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 67.72 30.93 6.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.878 2.071 . . . . 0.0 114.377 168.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -55.08 123.82 14.87 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.56 1.544 . . . . 0.0 110.3 175.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 t -140.77 178.8 7.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.645 1.178 . . . . 0.0 111.942 -169.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 92.0 t -131.22 135.6 59.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 125.645 1.578 . . . . 0.0 109.349 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 16.0 t -139.39 126.94 21.69 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.318 1.047 . . . . 0.0 109.872 172.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? 53.06 37.83 25.82 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.695 1.198 . . . . 0.0 111.742 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.53 -6.68 60.41 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 126.692 2.092 . . . . 0.0 115.719 178.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -98.2 134.01 41.83 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.128 1.371 . . . . 0.0 111.294 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.17 141.05 58.91 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.46 153.66 46.34 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.288 1.035 . . . . 0.0 112.771 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.32 148.62 68.46 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 126.013 1.725 . . . . 0.0 110.175 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.44 146.21 44.23 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.646 2.231 . . . . 0.0 110.902 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.8 mt -64.53 133.33 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.877 0.871 . . . . 0.0 110.752 176.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.99 179.3 47.18 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 126.294 1.902 . . . . 0.0 112.204 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.04 157.23 25.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.441 1.496 . . . . 0.0 111.502 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -161.78 154.83 25.91 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.365 0.983 . . . . 0.0 113.298 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -167.65 144.12 4.19 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.961 2.104 . . . . 0.0 109.641 -177.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -132.88 144.8 50.42 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.562 1.145 . . . . 0.0 111.548 -177.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.21 -1.6 4.68 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.203 1.401 . . . . 0.0 114.411 171.014 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.445 ' HB3' HG11 ' A' ' 128' ' ' VAL . 43.5 mt -72.82 121.8 20.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.208 1.803 . . . . 0.0 111.15 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -98.09 83.82 3.18 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.088 1.355 . . . . 0.0 110.791 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -69.66 -25.48 63.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.573 0.749 . . . . 0.0 112.309 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.45 -17.62 59.87 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.975 1.31 . . . . 0.0 113.65 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -113.49 0.45 14.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.949 1.7 . . . . 0.0 113.137 175.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.5 p -70.39 167.27 18.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.092 0.957 . . . . 0.0 113.261 175.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.6 p -134.03 142.06 47.46 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.9 1.28 . . . . 0.0 110.566 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.47 143.7 27.25 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.831 1.252 . . . . 0.0 111.846 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -140.15 121.13 14.61 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.681 1.992 . . . . 0.0 109.69 -175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.7 tp -65.62 134.79 54.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.946 0.898 . . . . 0.0 111.872 -171.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 50.6 mm -112.17 -42.07 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.071 1.348 . . . . 0.0 111.901 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.2 t -161.86 147.07 13.18 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 111.155 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HE2' HD13 ' A' ' 122' ' ' ILE . 33.1 ttmt -140.18 97.19 3.18 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.239 1.416 . . . . 0.0 109.221 -175.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -130.57 88.55 2.64 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.212 1.405 . . . . 0.0 111.361 -168.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 59.75 -116.56 9.16 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.863 0.744 . . . . 0.0 111.646 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.3 m -83.09 6.05 20.38 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.4 m -131.6 136.08 47.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.165 1.786 . . . . 0.0 110.507 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.406 HD13 ' HE2' ' A' ' 117' ' ' LYS . 98.5 mt -141.84 139.97 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.381 1.473 . . . . 0.0 109.623 -178.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.9 m -122.3 137.75 54.74 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.278 1.031 . . . . 0.0 111.416 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -125.03 150.04 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.499 1.919 . . . . 0.0 111.878 172.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -101.28 142.48 32.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.119 1.768 . . . . 0.0 108.241 168.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -120.1 121.0 37.87 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 126.195 1.798 . . . . 0.0 109.688 -176.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 36.4 m -98.94 112.88 24.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 172.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 105' ' ' LEU . 13.2 t -113.44 106.48 54.28 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 123.828 0.851 . . . . 0.0 110.85 -169.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -64.42 159.59 43.37 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.535 2.823 . . . . 0.0 111.473 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.8 p -108.86 151.12 26.69 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.493 0.717 . . . . 0.0 112.044 -175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.61 -6.76 54.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.86 1.264 . . . . 0.0 112.534 169.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -86.59 -23.22 25.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 112.935 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 89.29 7.27 69.99 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.655 1.121 . . . . 0.0 113.693 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.6 m -73.66 157.47 87.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.577 1.151 . . . . 0.0 112.078 170.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -54.25 145.0 57.31 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 124.282 3.321 . . . . 0.0 113.641 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 14.4 m -64.64 127.25 30.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.367 1.067 . . . . 0.0 113.616 -173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -79.79 141.13 36.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.788 1.635 . . . . 0.0 112.237 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -98.08 137.45 36.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.107 0.963 . . . . 0.0 111.916 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -137.12 158.52 44.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.69 2.396 . . . . 0.0 109.0 175.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -124.92 139.02 54.21 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.163 -0.96 . . . . 0.0 111.18 173.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.04 121.9 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.393 1.477 . . . . 0.0 109.496 -172.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 85.7 m -105.84 134.89 48.24 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.938 1.295 . . . . 0.0 109.474 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -115.71 145.11 43.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.826 2.051 . . . . 0.0 109.007 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -137.24 132.19 46.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 126.029 1.732 . . . . 0.0 108.056 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -82.79 132.66 35.16 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.502 0.668 . . . . 0.0 111.787 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -153.01 140.38 19.62 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.767 2.027 . . . . 0.0 108.474 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.9 m120 56.54 34.93 25.23 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.24 1.016 . . . . 0.0 112.873 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm 67.49 23.45 9.0 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.039 1.336 . . . . 0.0 113.134 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.85 139.01 30.7 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 111.815 -174.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -75.56 129.79 37.78 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.966 0.906 . . . . 0.0 111.915 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -134.63 158.81 43.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.811 2.044 . . . . 0.0 111.29 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.38 134.61 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.46 1.504 . . . . 0.0 110.175 175.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -81.43 5.66 16.95 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -154.74 129.04 9.0 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.484 1.114 . . . . 0.0 110.847 -175.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.23 -36.72 78.38 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.412 1.485 . . . . 0.0 114.368 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -111.17 23.51 13.99 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.804 2.042 . . . . 0.0 112.333 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.84 -27.27 66.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.301 1.041 . . . . 0.0 113.54 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 159' ' ' ILE . 86.7 t -137.51 115.73 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 126.215 1.806 . . . . 0.0 109.033 -173.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.413 HG23 ' O ' ' A' ' 158' ' ' VAL . 9.3 pt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.885 2.474 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -80.43 -16.63 53.95 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -155.52 157.56 37.08 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.471 1.509 . . . . 0.0 111.667 -176.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.2 m -144.71 139.89 28.22 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.429 1.892 . . . . 0.0 108.971 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.9 m -84.24 18.72 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.753 1.221 . . . . 0.0 114.13 -170.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.56 0.39 79.26 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.473 1.511 . . . . 0.0 113.669 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.3 -174.86 5.26 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.375 1.87 . . . . 0.0 112.192 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tt -117.7 130.05 56.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.115 1.366 . . . . 0.0 110.964 -171.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -109.73 171.27 7.55 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 127.306 2.243 . . . . 0.0 113.288 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.92 -43.61 77.52 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.872 1.269 . . . . 0.0 112.744 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 tppt? -63.7 -47.92 79.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.669 0.788 . . . . 0.0 112.033 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -56.37 -54.16 48.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.782 1.233 . . . . 0.0 110.48 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.74 79.6 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.362 0.665 . . . . 0.0 111.946 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.04 -43.64 95.2 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.887 1.275 . . . . 0.0 111.824 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -71.0 -42.2 69.94 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.918 -1.114 . . . . 0.0 111.859 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.1 mt -55.36 -40.5 71.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.05 0.94 . . . . 0.0 110.85 172.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.76 -49.55 70.31 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.257 1.023 . . . . 0.0 111.874 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -43.93 93.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.551 0.74 . . . . 0.0 111.971 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.5 t -66.33 -36.24 82.42 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.031 -0.418 . . . . 0.0 111.844 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.91 84.96 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.837 -1.165 . . . . 0.0 112.939 175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.24 89.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.132 0.878 . . . . 0.0 111.49 172.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -62.14 -48.75 78.74 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.722 0.809 . . . . 0.0 111.209 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -65.12 -38.18 89.84 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.261 -0.899 . . . . 0.0 112.711 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -61.18 -59.94 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.165 0.986 . . . . 0.0 111.13 174.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -65.89 -28.66 69.11 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -65.25 -53.42 44.62 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.327 0.512 . . . . 0.0 111.082 168.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 31.6 m -60.74 -44.98 95.99 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.638 0.775 . . . . 0.0 111.818 -176.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 84.1 mmm -65.53 -10.71 37.23 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 t -90.64 -4.97 56.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.669 1.187 . . . . 0.0 112.949 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.17 -0.64 72.4 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.48 1.514 . . . . 0.0 114.999 177.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -160.32 144.04 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.807 1.243 . . . . 0.0 112.868 -171.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -94.54 102.15 8.18 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.766 1.226 . . . . 0.0 111.608 172.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -60.88 -10.15 13.83 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.458 3.439 . . . . 0.0 114.23 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -59.05 -24.09 62.56 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 0.0 112.099 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.8 t -104.24 132.04 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 127.163 2.185 . . . . 0.0 108.928 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -110.69 -1.92 16.51 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -171.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -135.34 20.99 3.4 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.679 1.591 . . . . 0.0 113.438 -171.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.3 146.17 54.39 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.141 0.976 . . . . 0.0 111.244 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.0 t -86.3 120.42 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.662 1.185 . . . . 0.0 108.409 175.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.62 112.48 48.37 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.846 1.259 . . . . 0.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.23 140.12 75.78 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.169 2.579 . . . . 0.0 111.485 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.1 p -91.77 -1.98 57.15 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.39 161.48 32.62 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.409 1.48 . . . . 0.0 113.838 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.8 p -140.05 165.19 28.02 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.6 1.96 . . . . 0.0 110.011 174.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -148.92 -178.14 6.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.089 0.956 . . . . 0.0 111.859 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -126.62 131.13 51.54 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.47 1.108 . . . . 0.0 110.838 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -160.04 139.27 10.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.904 1.682 . . . . 0.0 110.637 -174.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 54.0 27.83 7.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.729 1.212 . . . . 0.0 113.173 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 69.68 21.02 6.73 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.36 1.864 . . . . 0.0 113.641 -176.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.7 mt -121.51 155.5 34.82 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.496 1.918 . . . . 0.0 110.248 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -88.87 128.93 35.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 168.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -105.53 147.87 27.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.951 1.7 . . . . 0.0 113.088 -178.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -123.84 137.13 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 125.034 1.333 . . . . 0.0 109.336 176.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -71.78 145.17 48.89 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.629 0.772 . . . . 0.0 112.328 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 47.7 mmm -78.92 149.95 32.24 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.203 0.601 . . . . 0.0 111.079 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 58.0 m -68.56 157.56 35.78 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.621 -0.674 . . . . 0.0 111.404 171.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.6 p -48.7 -34.9 12.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.232 2.679 . . . . 0.0 118.232 -166.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -74.23 -10.17 59.33 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.838 1.653 . . . . 0.0 113.577 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.6 mt -121.94 15.63 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.777 2.431 . . . . 0.0 110.212 169.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.26 -16.12 64.3 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.521 1.534 . . . . 0.0 116.267 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.4 p -131.36 159.07 39.01 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.602 1.561 . . . . 0.0 109.011 171.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -51.55 -48.13 63.18 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.964 0.506 . . . . 0.0 110.577 176.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.61 -42.29 87.82 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.874 0.87 . . . . 0.0 113.088 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -62.94 -40.82 98.81 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.434 1.015 . . . . 0.0 112.967 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.45 -39.26 67.94 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 69.4 t -57.48 -45.32 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.727 0.811 . . . . 0.0 109.955 171.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -61.91 -29.51 70.26 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -76.03 -34.58 59.66 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.19 -0.944 . . . . 0.0 112.586 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.63 -26.37 27.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.701 1.201 . . . . 0.0 113.379 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.3 m -46.86 -45.49 50.06 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 128.102 2.561 . . . . 0.0 114.325 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -57.64 -25.94 70.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.83 3.02 . . . . 0.0 115.344 176.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.33 -35.56 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.841 1.256 . . . . 0.0 112.551 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -122.45 141.22 51.85 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.525 1.53 . . . . 0.0 110.348 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -65.24 156.9 30.41 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 109.89 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -53.1 -46.97 68.91 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.506 -0.746 . . . . 0.0 111.372 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -63.49 -36.0 82.3 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.616 1.167 . . . . 0.0 113.089 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.9 92.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.297 0.953 . . . . 0.0 112.461 174.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.04 -47.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.627 0.771 . . . . 0.0 110.35 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.84 -41.61 91.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.111 0.414 . . . . 0.0 111.684 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -59.24 -46.92 87.21 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.644 0.778 . . . . 0.0 112.348 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -71.33 -33.69 64.36 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.8 0.727 . . . . 0.0 112.424 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -60.58 -46.17 91.23 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.26 1.53 . . . . 0.0 110.976 172.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -64.04 -45.69 87.74 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 172.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -67.12 -26.85 66.89 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -174.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -109.76 9.47 24.81 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.159 1.384 . . . . 0.0 113.088 178.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 66.66 30.23 8.35 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.555 1.942 . . . . 0.0 113.703 169.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -57.44 131.23 49.49 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.666 1.586 . . . . 0.0 110.983 176.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.8 t -141.27 178.59 7.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.393 1.077 . . . . 0.0 112.609 -170.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.6 t -127.86 135.52 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 125.842 1.657 . . . . 0.0 108.901 174.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.0 t -140.06 131.45 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.444 1.098 . . . . 0.0 109.566 171.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 53.36 33.12 15.04 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.074 0.95 . . . . 0.0 112.613 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.29 -5.13 68.7 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.603 2.049 . . . . 0.0 115.514 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -100.88 137.56 39.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.552 1.541 . . . . 0.0 111.86 -177.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.411 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -63.65 140.04 58.83 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 172.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.411 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -141.53 153.39 44.85 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 172.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.82 151.32 77.85 Favored Pre-proline 0 N--CA 1.478 0.96 0 C-N-CA 125.846 1.658 . . . . 0.0 110.101 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.82 147.62 39.8 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.448 2.099 . . . . 0.0 111.647 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.0 mt -62.94 134.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.5 1.12 . . . . 0.0 110.722 173.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.48 -172.11 40.85 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.973 1.749 . . . . 0.0 112.421 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -159.97 156.2 26.73 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.704 1.601 . . . . 0.0 111.432 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.0 159.19 32.5 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 124.204 0.906 . . . . 0.0 113.488 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -168.45 152.32 5.81 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.187 2.195 . . . . 0.0 109.679 -176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -133.64 139.62 46.59 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.55 1.14 . . . . 0.0 111.756 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.4 mt -67.16 -16.98 64.64 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.987 1.315 . . . . 0.0 112.939 171.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 72.3 mt -56.1 114.55 2.0 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.806 2.042 . . . . 0.0 111.998 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -94.94 82.67 3.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.638 1.575 . . . . 0.0 110.277 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -69.87 -24.61 63.45 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.446 0.698 . . . . 0.0 112.028 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -65.91 -17.21 64.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.933 1.293 . . . . 0.0 113.55 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.64 0.1 16.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.118 1.767 . . . . 0.0 113.091 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.4 p -70.42 164.35 24.79 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.865 0.866 . . . . 0.0 113.107 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 30.9 p -133.34 141.22 47.82 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.914 1.285 . . . . 0.0 110.713 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.55 149.98 21.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.514 1.126 . . . . 0.0 113.544 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.5 tttt -139.54 123.09 17.31 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.195 2.598 . . . . 0.0 109.241 -178.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.41 131.86 46.02 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.049 0.841 . . . . 0.0 111.06 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 48.1 mm -110.17 -38.81 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.444 1.498 . . . . 0.0 112.159 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.0 t -158.95 140.23 13.09 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.539 0.736 . . . . 0.0 110.911 -175.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -139.65 97.27 3.23 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.853 1.261 . . . . 0.0 109.173 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -135.56 90.7 2.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.735 1.214 . . . . 0.0 112.052 -168.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 61.9 -120.94 24.19 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 123.989 0.804 . . . . 0.0 111.371 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.3 m -82.62 7.83 13.6 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.8 m -130.49 136.05 48.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.167 1.787 . . . . 0.0 110.554 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.0 mt -141.32 140.05 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.354 1.461 . . . . 0.0 109.569 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.3 m -122.46 136.06 54.81 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.594 1.158 . . . . 0.0 111.325 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -122.81 148.38 45.45 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 126.014 1.726 . . . . 0.0 112.212 171.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -101.84 147.59 26.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.334 1.854 . . . . 0.0 108.117 168.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -127.78 127.68 44.0 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 126.172 1.789 . . . . 0.0 109.945 -175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 84.1 m -97.04 111.56 23.73 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 169.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 16.8 t -112.91 105.42 55.78 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 123.805 0.842 . . . . 0.0 110.449 -169.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -65.96 162.48 35.03 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.503 2.802 . . . . 0.0 111.454 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 p -109.81 153.68 24.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.497 0.719 . . . . 0.0 112.482 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.14 -6.91 56.2 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.278 1.431 . . . . 0.0 113.413 173.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -102.72 -7.29 21.81 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.199 1.4 . . . . 0.0 113.342 -179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.52 6.07 68.59 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 124.829 1.204 . . . . 0.0 114.367 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.2 m -69.84 151.92 96.18 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.53 1.132 . . . . 0.0 111.542 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -64.13 147.65 91.42 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.372 2.715 . . . . 0.0 111.653 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.1 m -58.3 132.07 52.52 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.018 1.327 . . . . 0.0 114.413 -170.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -80.75 141.71 34.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.184 1.394 . . . . 0.0 111.452 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.09 41.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.036 0.935 . . . . 0.0 111.269 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -136.15 151.12 49.43 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.09 2.156 . . . . 0.0 110.044 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -124.64 135.95 53.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.296 1.038 . . . . 0.0 111.331 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.5 t -136.77 124.56 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.786 1.635 . . . . 0.0 109.597 -171.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.6 m -109.09 135.38 50.34 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.776 1.23 . . . . 0.0 109.907 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -116.85 143.02 46.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.815 2.046 . . . . 0.0 109.003 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 69.6 t -134.01 128.6 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 125.804 1.641 . . . . 0.0 108.243 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -81.85 114.98 20.84 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 122.83 0.452 . . . . 0.0 110.538 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -99.33 -48.76 4.69 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -169.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -148.67 78.85 1.42 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.271 1.428 . . . . 0.0 109.845 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 64.27 13.03 7.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.196 1.798 . . . . 0.0 114.391 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -149.89 133.43 16.64 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.128 1.771 . . . . 0.0 113.206 -174.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.86 125.35 29.15 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.984 1.714 . . . . 0.0 112.231 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -130.47 153.12 49.12 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.705 1.602 . . . . 0.0 111.672 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.1 t -72.6 132.89 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.934 1.294 . . . . 0.0 110.027 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -81.55 6.43 14.92 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -177.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -155.93 130.65 9.09 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.122 1.369 . . . . 0.0 110.165 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 -45.3 80.23 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -89.29 16.16 7.86 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.341 1.456 . . . . 0.0 113.301 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.97 -30.43 70.25 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.236 1.014 . . . . 0.0 113.246 -175.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 26.0 t -145.61 119.49 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.872 1.669 . . . . 0.0 108.993 -175.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 10.4 pt . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.375 1.87 . . . . 0.0 111.828 -175.858 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -138.91 159.19 42.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.98 1.712 . . . . 0.0 111.624 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.35 159.94 41.23 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.929 1.691 . . . . 0.0 111.504 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 61.4 m -139.0 139.17 37.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.714 1.606 . . . . 0.0 109.795 -173.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 m -78.02 61.27 2.55 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.344 1.457 . . . . 0.0 112.61 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.17 64.89 3.08 Favored Glycine 0 N--CA 1.471 0.998 0 C-N-CA 125.718 1.627 . . . . 0.0 112.945 -177.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t0 73.72 -71.59 0.13 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 128.605 2.762 . . . . 0.0 112.345 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -113.97 125.71 54.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.46 1.504 . . . . 0.0 111.001 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -115.05 174.69 5.85 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.814 2.046 . . . . 0.0 112.871 -178.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -55.89 -41.95 75.22 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.846 1.258 . . . . 0.0 112.819 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.6 -46.67 78.44 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.423 0.689 . . . . 0.0 112.368 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -56.91 -52.68 64.2 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 0.0 110.544 174.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.96 -47.18 81.31 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.491 0.717 . . . . 0.0 111.864 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.79 -46.67 74.49 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.389 1.476 . . . . 0.0 112.131 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -72.27 -41.46 66.7 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.177 -0.952 . . . . 0.0 111.988 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.1 mt -54.56 -40.96 69.24 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.718 0.807 . . . . 0.0 110.88 171.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.04 72.17 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.253 1.021 . . . . 0.0 112.095 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.5 mt -62.61 -39.34 93.46 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.462 -0.774 . . . . 0.0 112.588 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.0 t -66.02 -38.09 87.53 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.824 -0.548 . . . . 0.0 111.623 174.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.34 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.914 -1.116 . . . . 0.0 112.428 172.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -58.24 -49.64 76.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 111.266 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -61.55 -45.92 92.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.939 1.296 . . . . 0.0 111.789 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.1 m80 -68.13 -43.16 78.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.444 0.698 . . . . 0.0 112.545 179.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -60.1 -55.25 36.18 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.11 0.964 . . . . 0.0 111.35 178.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -67.39 -37.14 82.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -26.57 63.0 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.366 0.985 . . . . 0.0 113.545 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 90.1 m -69.51 -43.85 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.662 0.785 . . . . 0.0 110.593 169.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.1 mmt -59.2 -35.37 73.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.119 0.872 . . . . 0.0 112.687 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.8 m -74.3 -8.2 55.41 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.402 1.481 . . . . 0.0 114.334 174.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.404 ' HA2' ' SD ' ' A' ' 55' ' ' MET . . . 77.79 14.13 82.7 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.259 1.409 . . . . 0.0 115.599 175.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -167.24 128.8 1.6 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.622 1.569 . . . . 0.0 113.246 -171.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -80.81 113.91 44.06 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 111.587 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.65 -14.59 40.95 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 124.642 3.561 . . . . 0.0 114.48 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -68.37 -21.46 64.71 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.337 0.971 . . . . 0.0 113.213 171.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 27.0 t -90.87 124.81 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.54 1.536 . . . . 0.0 108.951 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -105.34 -3.33 22.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.397 1.079 . . . . 0.0 113.831 -175.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.62 22.02 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.578 1.551 . . . . 0.0 113.589 -170.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.53 138.59 58.16 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.326 -0.859 . . . . 0.0 110.697 175.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 75.3 t -80.78 110.99 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 171.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.16 123.47 48.71 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.144 0.978 . . . . 0.0 110.909 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.62 172.69 15.71 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.604 2.869 . . . . 0.0 111.346 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 80.3 p -133.07 155.11 49.82 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.011 1.324 . . . . 0.0 112.312 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.81 178.07 52.22 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.322 0.963 . . . . 0.0 112.986 -170.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -146.15 170.12 17.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.176 1.791 . . . . 0.0 111.429 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -136.82 179.54 6.31 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.313 1.045 . . . . 0.0 111.563 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -129.62 131.52 46.49 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.52 1.128 . . . . 0.0 110.423 -176.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -158.34 136.35 10.65 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.705 1.602 . . . . 0.0 110.358 -174.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 54.55 28.92 10.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.684 1.194 . . . . 0.0 113.009 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 70.26 19.9 6.39 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 126.484 1.914 . . . . 0.0 113.642 -178.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.4 mt -118.36 153.43 34.03 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.034 1.733 . . . . 0.0 110.362 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -88.0 124.44 33.73 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -103.2 142.74 33.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.499 1.52 . . . . 0.0 112.933 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.9 m -117.69 136.75 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.304 1.442 . . . . 0.0 109.03 173.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -75.18 143.24 43.3 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.564 0.746 . . . . 0.0 111.564 171.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.404 ' SD ' ' HA2' ' A' ' 30' ' ' GLY . 14.1 mmm -74.8 155.62 37.39 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.373 0.669 . . . . 0.0 112.551 -178.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.21 161.73 30.46 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.631 -0.668 . . . . 0.0 110.315 168.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.8 p -59.19 -16.27 19.52 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 -167.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -73.17 -19.09 61.18 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.941 1.697 . . . . 0.0 114.045 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.16 21.07 4.86 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.615 2.366 . . . . 0.0 109.757 175.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.52 -25.03 68.34 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.972 1.748 . . . . 0.0 116.381 -166.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -127.05 161.23 28.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.695 1.247 . . . . 0.0 108.872 170.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -57.97 -36.28 72.37 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.72 -52.28 65.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.909 0.884 . . . . 0.0 111.707 172.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -54.07 -37.33 64.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.601 1.091 . . . . 0.0 113.654 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -44.38 49.06 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.48 -41.2 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 CA-C-N 119.034 0.834 . . . . 0.0 110.418 173.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -38.83 92.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.446 1.498 . . . . 0.0 112.505 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -69.54 -33.43 72.77 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.265 -0.897 . . . . 0.0 113.024 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.1 mt -86.54 -27.03 24.21 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.273 1.029 . . . . 0.0 113.574 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.4 m -45.44 -45.32 31.66 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 127.427 2.291 . . . . 0.0 114.307 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.7 -26.58 73.7 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.996 3.131 . . . . 0.0 115.547 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.6 mm -111.01 -34.31 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.81 1.244 . . . . 0.0 112.879 -172.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -122.76 143.12 50.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.596 1.558 . . . . 0.0 110.149 -170.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 p -67.08 156.33 36.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.909 0.483 . . . . 0.0 110.438 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -47.89 -50.26 27.22 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.609 0.764 . . . . 0.0 111.571 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.4 t -64.23 -37.93 89.23 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.636 1.174 . . . . 0.0 112.844 178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.7 99.37 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.242 0.928 . . . . 0.0 112.4 175.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.38 -49.84 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.58 0.752 . . . . 0.0 110.427 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -63.99 -39.23 93.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.117 0.417 . . . . 0.0 111.744 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.24 -45.9 91.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.498 0.719 . . . . 0.0 111.925 175.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.78 -34.18 66.33 Favored Glycine 0 CA--C 1.532 1.106 0 CA-C-O 119.189 -0.784 . . . . 0.0 112.483 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -62.67 -41.39 99.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.653 1.727 . . . . 0.0 111.105 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -67.08 -44.03 81.07 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 112.625 173.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.29 -27.75 66.59 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -106.88 8.08 30.45 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.241 1.416 . . . . 0.0 113.067 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 64.56 28.96 13.3 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.189 1.796 . . . . 0.0 113.338 171.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -56.74 138.95 52.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.146 1.378 . . . . 0.0 110.329 172.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -147.91 175.23 11.13 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.478 0.711 . . . . 0.0 112.39 -174.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.0 p -134.9 132.39 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 126.832 2.053 . . . . 0.0 110.004 -179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 21.2 t -130.68 114.96 16.03 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.468 1.107 . . . . 0.0 109.234 177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm 64.54 13.09 7.96 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.533 1.533 . . . . 0.0 113.511 -178.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.63 -16.58 47.68 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.743 1.64 . . . . 0.0 113.694 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -82.23 129.35 34.82 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.054 1.427 . . . . 0.0 111.055 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.7 tt -71.79 140.21 49.35 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.985 0.914 . . . . 0.0 108.912 174.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.405 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.87 150.49 46.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.821 0.849 . . . . 0.0 112.521 170.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.7 147.89 67.33 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 125.809 1.644 . . . . 0.0 110.07 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.42 145.65 38.41 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.403 2.069 . . . . 0.0 110.571 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 65.9 mt -63.72 133.1 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 123.756 0.823 . . . . 0.0 111.049 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -149.95 -163.45 11.13 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.425 1.964 . . . . 0.0 112.442 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -158.8 -41.6 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.607 1.163 . . . . 0.0 112.576 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 86.4 153.14 22.37 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.81 1.195 . . . . 0.0 114.277 173.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -163.91 152.44 13.4 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.879 1.672 . . . . 0.0 111.39 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -178.1 -23.02 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.17 2.188 . . . . 0.0 114.774 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 mp 58.58 10.43 1.4 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.934 2.494 . . . . 0.0 113.652 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 55.4 mt -71.32 128.0 34.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.988 1.715 . . . . 0.0 111.131 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -103.44 83.76 2.21 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.333 1.453 . . . . 0.0 110.302 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -71.9 -24.82 61.71 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.492 0.717 . . . . 0.0 112.284 -175.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -61.61 -17.71 56.36 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.393 1.077 . . . . 0.0 113.546 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -111.73 0.28 16.22 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 113.0 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 37.0 p -71.5 166.92 20.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.771 0.829 . . . . 0.0 113.103 174.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 33.4 p -137.54 140.84 41.3 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.013 1.325 . . . . 0.0 110.725 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.44 145.63 25.49 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.977 1.311 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -143.27 122.24 12.79 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.819 2.047 . . . . 0.0 109.31 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.2 tp -64.86 138.57 58.46 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.444 1.098 . . . . 0.0 112.317 -171.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.9 mm -119.13 -40.22 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.493 1.517 . . . . 0.0 112.34 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 6.3 t -157.59 149.21 21.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.394 0.677 . . . . 0.0 111.141 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -139.27 104.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.731 1.212 . . . . 0.0 110.546 -177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -116.64 171.52 7.81 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.05 2.14 . . . . 0.0 110.808 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.16 -32.55 63.38 Favored Glycine 0 N--CA 1.478 1.438 0 C-N-CA 124.5 1.048 . . . . 0.0 115.674 -169.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.9 m -138.24 17.51 2.78 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 118.266 1.033 . . . . 0.0 113.446 175.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 26.9 m -147.85 131.31 16.68 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.087 1.355 . . . . 0.0 109.82 -174.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 94.1 mt -138.48 136.31 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.506 1.123 . . . . 0.0 109.212 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.2 m -119.61 138.06 53.47 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.19 0.996 . . . . 0.0 111.023 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -127.47 146.74 50.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.423 1.889 . . . . 0.0 111.849 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -95.68 139.44 31.92 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 126.316 1.846 . . . . 0.0 107.606 168.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -119.62 122.34 41.33 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.138 1.775 . . . . 0.0 109.678 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 24.6 m -94.24 108.95 20.79 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 172.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.6 t -109.99 105.99 57.74 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.814 0.845 . . . . 0.0 110.48 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.44 161.97 40.95 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.485 2.79 . . . . 0.0 111.575 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.2 p -112.79 148.63 34.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.744 0.818 . . . . 0.0 112.074 -176.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.63 -7.95 58.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.113 1.365 . . . . 0.0 112.004 169.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -76.27 -24.79 54.49 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.804 1.642 . . . . 0.0 112.668 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.67 8.09 70.66 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.771 1.177 . . . . 0.0 113.638 -173.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 17.4 m -77.02 157.74 81.02 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.659 1.184 . . . . 0.0 112.086 171.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.02 146.7 46.54 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 124.138 3.225 . . . . 0.0 113.467 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.0 m -61.98 131.32 49.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.615 1.166 . . . . 0.0 113.961 -174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.83 135.37 34.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.389 1.476 . . . . 0.0 111.663 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -84.59 137.5 33.26 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.628 0.728 . . . . 0.0 112.918 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -131.75 155.59 47.45 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 127.939 2.496 . . . . 0.0 109.241 171.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.89 132.63 53.28 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.311 1.044 . . . . 0.0 110.84 172.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 42.8 t -134.06 123.49 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 125.281 1.433 . . . . 0.0 109.625 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 99.3 m -112.07 127.7 55.98 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 110.014 -177.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -106.0 133.5 50.61 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.822 2.049 . . . . 0.0 108.319 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 68.4 t -125.55 126.51 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.206 1.802 . . . . 0.0 107.997 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -82.35 106.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -78.81 -22.2 46.59 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -170.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -160.41 -64.67 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.389 1.475 . . . . 0.0 110.918 175.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.24 8.1 2.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.832 1.653 . . . . 0.0 112.832 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -148.04 135.81 20.92 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.398 1.879 . . . . 0.0 112.823 -175.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -77.22 124.26 27.58 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.833 1.653 . . . . 0.0 112.198 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -128.0 149.69 50.25 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.747 1.619 . . . . 0.0 111.43 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 11.7 t -72.84 131.22 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.493 1.117 . . . . 0.0 110.037 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -79.11 5.63 11.51 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -176.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -154.18 131.4 11.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.216 1.407 . . . . 0.0 109.684 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -68.47 -45.39 72.55 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -88.55 17.07 5.71 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.49 1.516 . . . . 0.0 113.323 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -61.06 -30.44 70.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.902 0.881 . . . . 0.0 113.218 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 61.1 t -145.05 111.13 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 C-N-CA 125.788 1.635 . . . . 0.0 109.232 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 C--O 1.251 1.134 0 O-C-N 124.91 1.382 . . . . 0.0 112.916 -173.814 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -156.94 136.84 12.53 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.356 1.462 . . . . 0.0 111.413 -177.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -162.1 148.06 13.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.442 1.497 . . . . 0.0 111.539 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.7 p -80.93 58.99 3.59 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.005 1.722 . . . . 0.0 111.196 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 m -68.4 -4.22 13.92 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.83 -16.59 80.63 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.507 1.051 . . . . 0.0 113.897 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -144.57 173.38 11.86 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.759 1.623 . . . . 0.0 112.369 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tt -100.5 131.18 46.55 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.618 1.167 . . . . 0.0 112.049 -167.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -117.63 166.37 12.48 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.188 1.795 . . . . 0.0 112.438 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -52.27 -44.4 64.92 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.191 1.397 . . . . 0.0 113.41 -172.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -61.2 -45.9 92.65 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.447 0.699 . . . . 0.0 112.058 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -63.71 -48.58 76.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.578 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.99 75.15 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.519 1.054 . . . . 0.0 111.76 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.53 -48.15 69.32 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.071 1.349 . . . . 0.0 111.845 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.51 -41.25 66.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.509 -0.744 . . . . 0.0 112.007 -177.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.84 -40.99 70.17 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.869 0.868 . . . . 0.0 110.838 172.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -48.48 72.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.128 0.971 . . . . 0.0 111.997 177.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.15 -40.13 94.95 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.667 -0.646 . . . . 0.0 112.283 176.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.3 t -66.61 -37.84 85.72 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.916 -0.49 . . . . 0.0 111.526 175.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.94 76.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.128 -0.982 . . . . 0.0 112.626 174.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -54.4 -50.76 66.82 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.15 0.98 . . . . 0.0 110.602 171.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -63.76 -51.44 64.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.673 0.789 . . . . 0.0 111.381 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -66.04 -26.41 67.5 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -173.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 159' ' ' ILE . 71.6 t80 -74.26 -61.75 1.75 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.82 0.848 . . . . 0.0 111.321 169.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.23 -35.73 76.11 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -172.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -65.04 -46.87 79.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.358 0.526 . . . . 0.0 112.229 173.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 55.9 m -64.37 -41.13 96.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.761 0.824 . . . . 0.0 111.388 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.5 mmm -63.54 -15.22 57.37 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.9 t -93.15 -5.49 50.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.171 1.388 . . . . 0.0 112.984 173.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.45 1.55 68.76 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 125.62 1.581 . . . . 0.0 115.586 175.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -159.0 142.9 15.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -170.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -100.1 108.22 51.05 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.696 1.599 . . . . 0.0 112.077 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -65.11 -7.21 14.77 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.359 3.373 . . . . 0.0 114.173 -176.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -60.2 -23.21 63.82 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.481 1.112 . . . . 0.0 112.069 168.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 26.0 t -107.25 123.27 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 126.409 1.884 . . . . 0.0 109.351 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -96.33 -6.27 38.09 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.519 1.128 . . . . 0.0 113.79 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -133.98 21.07 3.8 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.531 1.533 . . . . 0.0 113.608 -169.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.26 139.26 58.07 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.34 -0.85 . . . . 0.0 110.77 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 79.1 t -83.77 115.78 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.2 m -105.83 112.84 64.33 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.924 1.29 . . . . 0.0 110.944 -176.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -61.76 139.11 78.7 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.279 2.653 . . . . 0.0 111.947 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 58.0 p -90.4 -2.79 57.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.436 1.094 . . . . 0.0 113.751 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.12 154.6 24.57 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.559 1.552 . . . . 0.0 113.406 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.8 p -141.31 167.61 21.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.654 1.981 . . . . 0.0 110.329 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -148.23 179.18 7.96 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -124.26 131.1 53.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.57 1.148 . . . . 0.0 110.713 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -155.69 135.11 12.39 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.881 1.672 . . . . 0.0 110.334 -177.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 55.41 30.01 14.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.549 1.14 . . . . 0.0 112.64 -177.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.7 m120 68.68 16.42 9.0 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.921 2.088 . . . . 0.0 114.12 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -113.6 154.62 26.87 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.116 1.766 . . . . 0.0 110.358 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -87.74 128.63 35.31 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 169.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -105.71 141.65 36.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.817 1.647 . . . . 0.0 112.16 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.4 m -114.36 135.99 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.127 1.371 . . . . 0.0 109.378 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -74.72 140.13 43.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.348 0.659 . . . . 0.0 111.657 171.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 36.9 mmm -73.59 153.99 39.97 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.661 0.784 . . . . 0.0 111.949 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -68.25 154.32 41.98 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.553 -0.717 . . . . 0.0 111.119 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 76.9 p -48.22 -34.52 10.29 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -166.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -75.08 -9.48 58.58 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.815 1.643 . . . . 0.0 113.699 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.2 mt -121.77 14.26 10.85 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 127.897 2.479 . . . . 0.0 109.862 168.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.87 -19.54 71.65 Favored Glycine 0 C--N 1.342 0.894 0 C-N-CA 125.662 1.601 . . . . 0.0 115.807 -166.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.8 p -122.66 157.75 31.54 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.216 1.406 . . . . 0.0 108.628 169.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -56.47 -43.25 79.39 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.916 -0.49 . . . . 0.0 111.481 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.82 90.58 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.151 0.98 . . . . 0.0 113.2 174.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -62.43 -38.85 91.32 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.478 1.035 . . . . 0.0 112.796 174.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.5 -42.24 71.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.709 -0.619 . . . . 0.0 112.506 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.46 -43.79 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 CA-C-N 118.668 0.667 . . . . 0.0 110.495 172.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -63.38 -33.6 75.9 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.013 1.325 . . . . 0.0 114.14 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -74.07 -34.25 63.96 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.243 -0.911 . . . . 0.0 112.777 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.4 mt -84.8 -30.3 24.69 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 -175.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -45.4 -47.02 35.48 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 127.353 2.261 . . . . 0.0 114.246 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -55.07 -25.32 44.58 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 124.133 3.222 . . . . 0.0 115.432 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.8 mp -107.99 -38.62 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.745 1.218 . . . . 0.0 112.048 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -118.48 142.29 47.72 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.532 1.533 . . . . 0.0 111.169 -169.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.4 p -65.66 156.89 31.47 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 122.025 -0.422 . . . . 0.0 110.168 172.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -51.5 -46.66 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.622 -0.674 . . . . 0.0 111.352 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.5 m -62.17 -42.4 99.24 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.931 1.293 . . . . 0.0 112.605 177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.93 -34.62 74.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.214 0.916 . . . . 0.0 112.299 176.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.11 -48.99 51.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.893 0.877 . . . . 0.0 109.985 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.62 -40.23 86.9 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.224 0.465 . . . . 0.0 111.899 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.59 -47.3 86.1 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.804 0.841 . . . . 0.0 111.99 177.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -72.18 -31.65 63.69 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.541 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -61.33 -43.79 98.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.292 1.546 . . . . 0.0 110.93 171.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.06 -45.91 79.64 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.139 -0.976 . . . . 0.0 112.633 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -67.04 -27.57 67.51 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -173.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -109.34 7.89 25.31 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.276 1.431 . . . . 0.0 113.08 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 68.54 26.1 6.54 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.564 1.945 . . . . 0.0 114.103 169.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -52.8 134.73 36.6 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.234 1.414 . . . . 0.0 110.066 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.4 t -144.91 175.1 10.46 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.745 0.818 . . . . 0.0 111.799 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -137.63 130.9 42.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.265 1.826 . . . . 0.0 110.483 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 14.8 t -132.22 115.54 15.82 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.725 1.21 . . . . 0.0 109.193 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 60.95 15.68 6.29 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.37 1.468 . . . . 0.0 113.837 -173.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.5 -11.99 61.43 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 125.249 1.404 . . . . 0.0 113.665 -174.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -82.79 127.22 33.25 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.754 1.277 . . . . 0.0 110.529 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.406 HD23 ' N ' ' A' ' 95' ' ' ALA . 1.5 tt -71.72 138.01 48.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.094 0.958 . . . . 0.0 109.067 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.406 ' N ' HD23 ' A' ' 94' ' ' LEU . . . -138.02 152.19 48.62 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.106 0.962 . . . . 0.0 112.987 171.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.7 m -133.74 149.2 71.31 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 125.849 1.66 . . . . 0.0 110.203 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.43 145.47 42.8 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.596 2.197 . . . . 0.0 111.023 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.69 133.14 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.05 0.94 . . . . 0.0 110.343 174.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -162.31 -172.12 29.34 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.82 1.676 . . . . 0.0 112.687 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -158.32 141.5 14.97 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.379 1.471 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.2 153.64 23.9 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.365 0.984 . . . . 0.0 113.599 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -169.0 137.5 2.03 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.925 2.09 . . . . 0.0 109.75 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -111.71 138.34 48.41 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.264 1.026 . . . . 0.0 111.766 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.43 -1.25 4.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.353 1.461 . . . . 0.0 114.45 171.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.464 ' HB3' HG11 ' A' ' 128' ' ' VAL . 58.9 mt -70.21 124.75 24.89 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.267 1.827 . . . . 0.0 110.693 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -98.86 82.35 2.76 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.814 1.245 . . . . 0.0 110.65 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.4 -26.76 64.8 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.452 0.701 . . . . 0.0 112.042 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -17.67 61.79 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.897 1.279 . . . . 0.0 113.79 173.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.28 0.48 15.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.768 1.627 . . . . 0.0 113.059 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.6 p -70.96 167.08 19.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.035 0.934 . . . . 0.0 113.402 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.1 p -133.07 141.64 48.32 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.044 1.337 . . . . 0.0 110.652 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.0 144.41 26.92 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.898 1.279 . . . . 0.0 112.389 178.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -135.51 124.46 24.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.812 2.445 . . . . 0.0 109.142 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.65 132.68 48.66 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.832 0.742 . . . . 0.0 111.029 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 49.4 mm -110.03 -40.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.356 1.462 . . . . 0.0 111.911 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.2 t -160.19 136.95 9.07 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.484 0.714 . . . . 0.0 110.969 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -130.62 110.84 11.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.847 1.259 . . . . 0.0 110.416 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -134.06 173.87 11.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.971 1.708 . . . . 0.0 111.494 -172.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -60.3 108.54 1.83 Allowed Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.134 0.873 . . . . 0.0 111.683 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.4 m 68.18 5.08 4.45 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.941 2.096 . . . . 0.0 115.6 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 21.9 m -141.29 130.09 22.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.387 1.475 . . . . 0.0 110.341 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 90.6 mt -140.47 136.71 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.783 1.233 . . . . 0.0 109.876 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 23.5 m -116.85 137.13 52.42 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.468 1.107 . . . . 0.0 111.323 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -124.46 150.13 46.06 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.291 1.836 . . . . 0.0 112.141 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.49 143.87 30.16 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.911 1.684 . . . . 0.0 107.803 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -119.69 123.64 44.29 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.545 1.938 . . . . 0.0 109.502 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 53.8 m -97.62 108.21 20.87 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 105' ' ' LEU . 11.9 t -111.02 105.42 57.11 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.553 0.741 . . . . 0.0 110.729 -169.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.55 159.69 43.41 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.457 2.771 . . . . 0.0 111.045 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.3 p -109.4 150.07 28.6 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.46 0.648 . . . . 0.0 112.217 -175.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.14 -9.74 58.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.045 1.338 . . . . 0.0 112.519 170.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.12 -22.31 39.2 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.881 1.672 . . . . 0.0 112.822 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.31 7.35 73.01 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 124.848 1.213 . . . . 0.0 113.753 -174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.8 m -73.86 156.99 87.79 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.469 1.108 . . . . 0.0 112.06 169.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.21 147.4 45.2 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.255 3.303 . . . . 0.0 113.86 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.4 m -61.37 130.66 47.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.58 1.152 . . . . 0.0 114.047 -174.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.95 138.43 33.14 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.451 1.501 . . . . 0.0 112.045 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -85.96 134.53 33.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.718 0.807 . . . . 0.0 112.569 169.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -130.73 153.6 48.84 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.647 2.379 . . . . 0.0 108.998 169.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -124.68 132.55 53.39 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.221 1.009 . . . . 0.0 110.709 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -133.89 121.4 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.364 1.466 . . . . 0.0 109.197 -169.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 97.0 m -107.4 133.64 51.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.532 1.133 . . . . 0.0 109.648 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -113.54 140.39 48.19 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.546 1.938 . . . . 0.0 108.663 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.9 t -130.14 128.63 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 126.246 1.818 . . . . 0.0 107.795 -178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -80.04 128.81 33.93 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.257 0.551 . . . . 0.0 110.633 176.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -141.76 116.6 9.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 107.38 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 52.86 72.97 0.38 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.508 1.123 . . . . 0.0 112.214 -174.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . 0.297 47.2 pttt 60.33 13.04 3.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.955 2.502 . . . . 0.0 116.789 169.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . 0.489 ' HG3' ' HE3' ' A' ' 151' ' ' LYS . 11.3 ptmt -152.78 139.49 18.87 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.003 1.321 . . . . 0.0 114.167 -175.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -77.56 131.97 38.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.946 1.698 . . . . 0.0 112.496 -178.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 149' ' ' LYS . 62.0 mttt -138.01 152.4 48.84 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.103 1.761 . . . . 0.0 111.023 -175.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 12.4 t -72.4 133.94 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 125.265 1.426 . . . . 0.0 110.171 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -82.29 6.82 15.63 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -153.87 130.21 10.52 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.965 1.306 . . . . 0.0 110.423 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -64.28 -40.66 96.41 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.707 1.203 . . . . 0.0 113.786 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -102.1 20.62 16.29 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.293 1.837 . . . . 0.0 112.955 -176.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.92 66.43 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.62 121.14 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.449 1.899 . . . . 0.0 108.613 -172.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG21 ' CE2' ' A' ' 24' ' ' PHE . 2.4 pt . . . . . 0 C--O 1.251 1.176 0 O-C-N 124.753 1.283 . . . . 0.0 113.519 -173.8 . . . . . . . . 1 1 . 1 stop_ save_