data_2kbi_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 2kbi _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 CA--C 1.545 0.779 0 CA-C-O 121.467 0.651 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.802 0.334 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 121.256 0.55 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.022 0.439 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 121.021 0.439 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.688 0.28 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1855 ' ' PHE . . . . . 0.405 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1859 ' ' LYS . . . . . 0.405 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 121.008 0.432 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.746 0.307 . . . . 0.0 111.464 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1855 ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1859 ' ' LYS . . . . . 0.444 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.981 0.419 . . . . 0.0 111.674 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.625 0.726 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 N--CA 1.47 0.554 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.136 0.493 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 111.695 0.258 . . . . 0.0 111.695 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.981 0.42 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 120.992 0.425 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.57 165.95 31.24 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.213 3.275 . . . . 0.0 112.792 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -90.91 -178.23 43.53 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.306 1.432 . . . . 0.0 113.772 175.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.5 m 57.36 28.33 15.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.973 1.709 . . . . 0.0 115.151 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . 0.274 11.6 pt-20 46.99 -65.83 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 130.858 3.663 . . . . 0.0 117.929 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.75 -31.67 72.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.649 1.58 . . . . 0.0 112.723 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 19.8 p90 50.53 -19.89 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 131.479 3.911 . . . . 0.0 119.151 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.6 t -82.48 176.57 9.3 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.8 1.64 . . . . 0.0 112.996 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 3.2 t -128.82 -6.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 127.117 2.167 . . . . 0.0 112.229 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -144.29 -175.35 4.59 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.103 1.761 . . . . 0.0 112.576 -174.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.6 t -137.69 175.04 9.94 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.16 1.784 . . . . 0.0 111.969 169.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -127.43 -5.99 5.89 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.074 1.75 . . . . 0.0 114.239 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -71.63 110.01 5.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.673 1.589 . . . . 0.0 112.123 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.2 m -65.46 159.3 24.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.161 1.385 . . . . 0.0 113.904 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 19.5 p -136.59 98.05 3.71 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.019 1.727 . . . . 0.0 111.147 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.98 158.6 61.64 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 125.95 1.7 . . . . 0.0 111.868 178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -78.37 -20.04 11.34 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.52 2.146 . . . . 0.0 114.216 -176.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt -88.86 166.45 13.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 0.0 112.4 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t -63.61 -42.65 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.52 -16.55 62.9 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.762 1.625 . . . . 0.0 113.397 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 75.46 15.86 80.96 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 124.863 1.221 . . . . 0.0 114.995 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -79.51 82.72 5.6 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.379 1.472 . . . . 0.0 112.004 -175.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.485 1.289 0 C-N-CA 127.1 2.16 . . . . 0.0 112.027 176.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.457 0 CA-C-O 119.413 -0.659 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.0 -17.44 17.43 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.011 3.141 . . . . 0.0 114.834 -177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -78.91 166.77 52.19 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.09 1.329 . . . . 0.0 114.437 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 58.5 p -78.62 -8.52 58.73 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.925 1.69 . . . . 0.0 115.542 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 61.45 159.48 0.05 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 128.698 2.799 . . . . 0.0 114.624 -172.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -67.59 -23.88 65.44 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.422 -1.424 . . . . 0.0 113.968 -177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -143.35 159.78 41.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.271 1.029 . . . . 0.0 113.422 -174.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 20.5 m -82.84 15.79 2.53 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.816 2.046 . . . . 0.0 115.394 -170.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.4 m -65.35 -2.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 N-CA-C 116.798 2.147 . . . . 0.0 116.798 -170.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -56.21 139.1 48.89 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.73 1.212 . . . . 0.0 112.725 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 16.0 m -69.79 -33.96 73.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.456 1.503 . . . . 0.0 113.555 -171.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.92 173.41 11.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.325 1.45 . . . . 0.0 113.799 -172.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.62 149.63 36.07 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.226 1.81 . . . . 0.0 110.67 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 21.9 m -77.98 57.54 1.78 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.473 1.909 . . . . 0.0 113.857 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 63.4 p -80.21 4.69 16.73 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 126.186 1.795 . . . . 0.0 115.709 -176.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -65.37 148.01 98.27 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.839 1.656 . . . . 0.0 113.259 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -79.97 -6.59 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.132 3.221 . . . . 0.0 113.996 175.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt -124.86 161.2 27.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.891 2.077 . . . . 0.0 110.855 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t -68.56 -46.92 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 52.8 mt -71.4 -17.09 62.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.889 2.076 . . . . 0.0 113.758 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 76.91 16.36 80.84 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 124.574 1.083 . . . . 0.0 114.819 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -80.12 -16.58 54.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.716 1.206 . . . . 0.0 114.076 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 124.678 1.191 . . . . 0.0 112.795 170.602 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.518 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.78 165.93 31.39 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.663 2.909 . . . . 0.0 113.037 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -68.82 -12.62 64.99 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.863 1.221 . . . . 0.0 115.2 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 74.7 m -65.13 -15.52 62.49 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -108.89 -25.75 10.6 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.306 1.442 . . . . 0.0 113.55 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -135.28 96.4 3.47 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.011 1.724 . . . . 0.0 110.576 -175.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 53.9 p90 -144.95 171.95 13.73 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.442 1.497 . . . . 0.0 113.258 -175.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 8.6 t -142.79 176.46 9.04 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.403 1.881 . . . . 0.0 110.44 169.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 t -127.85 85.51 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.617 1.567 . . . . 0.0 109.533 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -74.47 -14.87 60.89 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . 0.257 2.5 t 46.66 -174.04 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 129.885 3.274 . . . . 0.0 115.347 -175.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.09 148.43 47.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.442 1.497 . . . . 0.0 112.344 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -152.68 133.04 13.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.27 1.428 . . . . 0.0 111.173 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 46.5 m -70.36 156.58 39.12 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.74 1.216 . . . . 0.0 113.086 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 49.4 p -132.26 5.92 4.14 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.19 141.27 88.67 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.473 1.109 . . . . 0.0 112.246 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.12 -10.05 15.19 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 123.348 2.698 . . . . 0.0 114.427 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt -131.47 159.73 37.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.501 1.92 . . . . 0.0 111.531 -173.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t -65.32 -41.91 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 49.3 mt -69.38 -12.55 61.75 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.135 1.774 . . . . 0.0 113.608 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.54 12.92 84.06 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.524 1.535 . . . . 0.0 114.546 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -80.91 -14.34 58.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.004 1.321 . . . . 0.0 114.004 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.251 1.147 0 C-N-CA 126.926 2.09 . . . . 0.0 112.273 -176.818 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.547 0 CA-C-O 119.882 -0.399 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.37 -18.09 18.24 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.904 3.07 . . . . 0.0 114.07 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.67 -16.1 8.7 Favored Glycine 0 CA--C 1.542 1.766 0 C-N-CA 125.873 1.701 . . . . 0.0 115.24 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 61.9 p -74.6 -14.71 60.81 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.901 1.68 . . . . 0.0 114.161 173.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -144.95 141.27 28.86 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.814 2.046 . . . . 0.0 110.771 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -147.57 147.1 29.72 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.42 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.35 -19.97 61.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.2 p -61.43 -13.25 18.85 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -170.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.0 m -60.09 -19.61 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.12 1.368 . . . . 0.0 113.598 168.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.06 -15.09 61.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.273 1.829 . . . . 0.0 114.346 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 86.8 m -95.32 -59.5 1.87 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.724 1.609 . . . . 0.0 110.208 174.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.45 156.17 38.95 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.997 1.319 . . . . 0.0 112.315 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.31 87.37 6.96 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.602 1.161 . . . . 0.0 111.311 174.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.4 p -67.0 -6.14 15.72 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.284 1.833 . . . . 0.0 115.402 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 13.1 p -75.33 65.18 1.61 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.814 2.446 . . . . 0.0 112.329 176.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -60.98 148.07 84.67 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 125.043 1.337 . . . . 0.0 113.117 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -84.77 -2.7 9.77 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.368 2.712 . . . . 0.0 115.517 -168.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -129.31 157.5 41.72 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.176 1.39 . . . . 0.0 112.218 -175.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t -82.66 -47.03 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.73 -34.92 78.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.957 1.303 . . . . 0.0 113.146 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 79.8 -6.24 59.35 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 126.499 2.0 . . . . 0.0 116.541 171.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.27 22.72 6.46 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 126.75 2.02 . . . . 0.0 114.451 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.921 2.088 . . . . 0.0 113.951 -178.999 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-O 119.089 -0.839 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.14 167.31 27.49 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.739 2.96 . . . . 0.0 113.282 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -155.62 23.79 0.56 Allowed Glycine 0 N--CA 1.475 1.279 0 C-N-CA 125.566 1.555 . . . . 0.0 114.451 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 15.1 m -62.76 -12.35 23.57 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -164.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.09 -39.77 60.24 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.875 1.67 . . . . 0.0 112.725 166.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 47.2 t30 -82.62 -14.65 54.38 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.223 1.409 . . . . 0.0 114.042 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -84.71 168.09 15.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.663 1.185 . . . . 0.0 112.849 -173.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 15.8 m -70.02 3.1 2.92 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.598 1.959 . . . . 0.0 115.703 -176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.7 m -66.32 -12.34 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 126.187 1.795 . . . . 0.0 115.321 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -68.24 160.84 28.47 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.207 1.403 . . . . 0.0 113.316 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 10.8 t -74.24 166.02 24.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.827 0.851 . . . . 0.0 112.089 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -132.96 1.62 3.58 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.224 1.81 . . . . 0.0 113.717 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.92 153.05 46.84 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.758 1.223 . . . . 0.0 114.004 -175.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.1 m -147.23 88.57 1.73 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.328 2.251 . . . . 0.0 108.935 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.7 m -134.33 149.87 50.9 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.62 1.168 . . . . 0.0 112.084 -163.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -137.22 156.84 75.21 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.63 1.972 . . . . 0.0 111.044 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.66 -7.06 12.59 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.287 2.658 . . . . 0.0 115.708 -167.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt -129.59 166.7 19.21 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 112.067 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t -65.16 -35.8 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.36 -9.11 55.32 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.032 1.733 . . . . 0.0 114.71 174.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 117.79 11.66 8.36 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 125.452 1.501 . . . . 0.0 116.134 172.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.97 -4.11 0.85 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 128.617 2.767 . . . . 0.0 115.59 -176.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.334 2.254 . . . . 0.0 113.43 175.501 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.81 92.06 0.52 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.835 3.69 . . . . 0.0 111.876 -178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -144.04 11.95 2.1 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.709 1.623 . . . . 0.0 114.974 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.4 m -58.95 134.78 57.26 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 113.016 -175.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.35 4.58 2.67 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.285 1.434 . . . . 0.0 113.642 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -62.2 -18.91 62.41 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.453 1.501 . . . . 0.0 114.184 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 42.1 p90 -66.58 -15.64 63.58 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.225 1.41 . . . . 0.0 114.447 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 71.3 m -74.42 81.24 1.91 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.5 1.52 . . . . 0.0 112.516 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 58.4 t -65.79 113.97 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.591 1.556 . . . . 0.0 110.747 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -72.89 -175.7 1.82 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.112 1.365 . . . . 0.0 113.809 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 23.1 p -131.94 160.7 35.02 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.398 1.879 . . . . 0.0 112.528 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -78.1 145.78 35.57 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.014 1.325 . . . . 0.0 111.654 175.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -95.26 -7.22 39.48 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -176.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 25.6 m -74.25 -3.76 31.96 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.146 1.778 . . . . 0.0 114.417 -176.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 64.5 p -73.61 25.6 0.07 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 128.732 2.813 . . . . 0.0 115.094 -174.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -58.43 147.51 68.31 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.499 1.52 . . . . 0.0 113.401 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -79.45 -9.37 14.92 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.63 2.887 . . . . 0.0 114.576 -174.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt -133.52 156.07 48.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.938 2.095 . . . . 0.0 111.018 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t -67.95 -42.75 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.46 -9.13 52.34 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.884 1.673 . . . . 0.0 114.234 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 102.6 7.36 45.43 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.515 1.531 . . . . 0.0 115.393 171.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 62.9 -1.89 0.44 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.036 2.534 . . . . 0.0 116.484 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.652 1.981 . . . . 0.0 112.045 -176.963 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -56.75 -27.11 69.63 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.756 3.638 . . . . 0.0 115.959 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -177.56 -177.94 46.78 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 125.797 1.665 . . . . 0.0 113.09 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.4 t -144.6 170.34 16.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.514 1.526 . . . . 0.0 111.923 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.07 166.61 22.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.567 1.547 . . . . 0.0 113.507 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 1.4 t30 -78.06 76.07 4.58 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.671 1.189 . . . . 0.0 110.272 169.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.8 t80 -69.18 97.17 0.89 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.462 1.505 . . . . 0.0 112.236 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 55.4 m -142.56 147.61 36.19 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.641 1.576 . . . . 0.0 111.335 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 47.6 t -74.95 -34.97 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.195 0.998 . . . . 0.0 111.914 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.03 134.65 55.4 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.352 1.461 . . . . 0.0 111.597 173.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.8 t -150.77 159.67 44.38 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.783 1.233 . . . . 0.0 111.772 -177.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -61.42 -22.41 64.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.203 1.401 . . . . 0.0 113.137 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -72.51 -11.39 60.64 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.659 1.184 . . . . 0.0 114.179 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 38.4 m -135.24 -15.78 1.92 Allowed 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -169.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 6.3 t -155.48 169.83 23.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.747 1.219 . . . . 0.0 112.699 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.44 154.38 69.45 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 127.664 2.386 . . . . 0.0 110.768 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.27 -6.47 13.83 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.842 2.361 . . . . 0.0 114.87 -172.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt -132.17 156.72 45.92 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 111.917 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t -70.66 -49.12 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 56.5 mt -65.9 -24.47 66.85 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.922 1.689 . . . . 0.0 113.634 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 71.88 24.93 75.92 Favored Glycine 0 CA--C 1.539 1.547 0 C-N-CA 124.211 0.91 . . . . 0.0 113.607 -172.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -59.02 129.32 41.61 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.407 1.483 . . . . 0.0 111.722 -176.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.429 1.892 . . . . 0.0 112.505 -173.578 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.41 168.12 1.63 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.663 3.575 . . . . 0.0 115.471 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -77.19 96.7 1.24 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.333 1.444 . . . . 0.0 112.351 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 50.7 m -63.34 -16.68 61.12 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -173.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -138.61 114.44 9.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 111.521 176.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 31.0 t30 -68.37 -37.02 80.03 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.228 1.411 . . . . 0.0 113.754 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -70.72 154.51 41.78 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.119 1.155 . . . . 0.0 114.119 -164.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.7 p -137.45 -3.29 1.92 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . 0.262 26.1 m 45.58 28.13 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 128.305 2.642 . . . . 0.0 115.527 -175.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.76 172.46 3.5 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.465 1.506 . . . . 0.0 114.063 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.6 t -58.32 -22.49 53.28 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.688 1.595 . . . . 0.0 114.52 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -60.2 -18.96 51.95 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.028 1.331 . . . . 0.0 113.378 173.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.33 -17.68 62.43 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.152 1.381 . . . . 0.0 113.778 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.8 m -124.9 -6.49 7.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.553 1.541 . . . . 0.0 115.103 -169.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 5.3 t -74.68 167.2 22.26 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.426 1.09 . . . . 0.0 112.511 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -150.95 141.63 14.77 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.589 1.555 . . . . 0.0 112.128 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.68 -8.74 8.15 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.403 2.736 . . . . 0.0 114.906 -171.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt -130.0 159.72 35.85 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.339 1.856 . . . . 0.0 111.37 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1855 ' ' PHE . . . . . 0.405 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1859 ' ' LYS . . . . . 0.405 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t -63.94 -40.86 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 36.0 mt -71.12 -9.07 57.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.862 1.665 . . . . 0.0 113.827 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 82.54 8.41 86.19 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.505 1.526 . . . . 0.0 114.667 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.37 -19.01 47.34 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.277 1.431 . . . . 0.0 113.395 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.252 1.217 0 C-N-CA 127.144 2.178 . . . . 0.0 112.317 179.168 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 CA-C-O 119.717 -0.491 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -58.25 -21.32 51.62 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.669 3.579 . . . . 0.0 116.133 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 91.52 -6.16 80.35 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 125.184 1.373 . . . . 0.0 114.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.3 t -68.32 152.86 44.83 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.025 0.93 . . . . 0.0 111.589 170.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.84 -18.32 59.6 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.164 -0.96 . . . . 0.0 113.567 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.72 -33.85 75.96 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.372 1.069 . . . . 0.0 112.548 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 65.2 t80 -70.78 -35.68 72.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.852 0.861 . . . . 0.0 111.777 173.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 16.0 m -67.39 -9.01 37.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.874 1.67 . . . . 0.0 114.943 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 90.6 t -61.25 -19.67 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 126.089 1.756 . . . . 0.0 112.589 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.31 -7.66 10.28 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.189 1.796 . . . . 0.0 115.275 171.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 47.7 m -131.51 151.66 51.38 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.286 2.234 . . . . 0.0 110.604 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 66.65 -44.37 0.43 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 129.006 2.922 . . . . 0.0 114.669 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.62 2.64 0.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 128.063 2.545 . . . . 0.0 117.528 162.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 22.6 t -149.5 160.08 43.76 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.793 1.237 . . . . 0.0 112.797 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 70.9 p -131.04 4.75 4.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.265 2.226 . . . . 0.0 112.596 173.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -94.89 158.04 35.72 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.915 1.686 . . . . 0.0 113.456 -171.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.41 -5.75 15.83 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 123.978 3.118 . . . . 0.0 114.452 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt -125.16 155.68 39.58 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.111 2.164 . . . . 0.0 110.75 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t -69.19 -39.06 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 83.4 mt -71.22 -11.29 60.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.686 1.594 . . . . 0.0 114.08 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.53 18.49 77.62 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.061 1.315 . . . . 0.0 114.904 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -102.75 88.24 3.16 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.316 1.847 . . . . 0.0 111.478 -171.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 46.4 p . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.641 1.576 . . . . 0.0 114.616 174.461 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.284 -0.731 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -55.43 173.15 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 125.239 3.96 . . . . 0.0 114.889 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -60.21 -15.14 36.12 Favored Glycine 0 CA--C 1.54 1.644 0 C-N-CA 124.626 1.107 . . . . 0.0 115.648 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.5 p -66.31 -9.75 36.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.088 1.755 . . . . 0.0 114.582 171.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -58.66 -33.07 69.69 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.88 1.672 . . . . 0.0 113.205 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.01 118.71 6.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.998 1.719 . . . . 0.0 113.357 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 43.3 p90 -70.99 -2.21 14.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.239 1.416 . . . . 0.0 113.702 166.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.0 m -59.58 -8.79 2.11 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.253 2.621 . . . . 0.0 116.539 -170.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 32.8 m -60.04 -12.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.619 1.968 . . . . 0.0 114.46 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -70.61 -6.51 37.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.408 1.883 . . . . 0.0 114.992 172.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.9 p -123.44 177.7 5.51 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.777 1.631 . . . . 0.0 113.389 -172.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -130.9 138.52 49.83 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.184 1.793 . . . . 0.0 111.73 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -75.62 -13.89 60.35 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.045 1.338 . . . . 0.0 114.53 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 3.5 t 64.23 -13.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 128.37 2.668 . . . . 0.0 116.04 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 3.8 m 47.04 58.16 5.05 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.592 2.757 . . . . 0.0 113.55 169.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.12 153.21 96.27 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 120.973 -1.079 . . . . 0.0 111.39 167.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.55 -20.22 18.21 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.765 2.31 . . . . 0.0 113.947 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt -134.52 152.65 51.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.036 1.734 . . . . 0.0 111.649 -176.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -59.82 -46.01 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.21 -14.38 62.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.658 1.583 . . . . 0.0 113.511 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 68.5 18.99 72.35 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 124.83 1.205 . . . . 0.0 114.014 -175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -84.78 68.79 10.58 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.165 1.386 . . . . 0.0 111.573 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.723 2.009 . . . . 0.0 113.475 -179.336 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.588 0 CA-C-O 118.154 -1.359 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -54.18 157.16 11.66 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.462 3.442 . . . . 0.0 114.814 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -103.42 15.91 53.19 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 126.197 1.856 . . . . 0.0 115.075 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 23.6 m -54.26 142.81 24.99 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.185 1.794 . . . . 0.0 113.567 -173.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -67.07 168.17 10.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.765 1.226 . . . . 0.0 113.698 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.27 173.37 15.1 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.934 1.694 . . . . 0.0 111.526 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -177.34 0.38 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.457 1.103 . . . . 0.0 113.009 164.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 18.5 t -66.56 98.08 0.48 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.912 -1.117 . . . . 0.0 111.145 170.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.2 m -71.53 -10.92 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.796 1.638 . . . . 0.0 114.555 -176.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.88 153.16 42.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.964 1.306 . . . . 0.0 112.841 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.2 m -64.64 126.65 28.58 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.128 1.371 . . . . 0.0 110.968 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -70.85 -9.61 57.93 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -127.83 118.81 24.39 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.383 1.873 . . . . 0.0 110.656 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 24.5 m -72.69 -2.37 19.93 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.91 1.684 . . . . 0.0 115.346 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 56.6 p 41.67 57.63 3.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.684 2.393 . . . . 0.0 113.978 -177.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -62.94 151.99 84.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.382 1.473 . . . . 0.0 113.243 -175.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.53 -4.83 15.03 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.039 3.159 . . . . 0.0 114.733 -174.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt -126.07 153.67 44.14 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.448 1.499 . . . . 0.0 112.463 -172.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t -85.92 -44.43 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.62 -16.0 63.3 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.172 1.789 . . . . 0.0 113.5 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 91.12 13.44 58.87 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.518 1.532 . . . . 0.0 114.364 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -81.9 7.09 13.84 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.088 1.355 . . . . 0.0 113.832 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.256 1.439 0 C-N-CA 128.232 2.613 . . . . 0.0 114.385 177.363 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.342 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -56.06 -22.09 37.61 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 124.461 3.441 . . . . 0.0 116.991 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -80.45 60.78 4.51 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.638 1.589 . . . . 0.0 113.673 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -74.25 61.19 0.86 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 112.9 176.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.96 -3.22 18.27 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.34 1.856 . . . . 0.0 114.885 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.95 164.56 2.84 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.394 1.878 . . . . 0.0 114.147 175.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 70.8 t80 -65.35 159.68 23.51 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.666 1.187 . . . . 0.0 112.412 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 25.2 m -67.11 157.16 34.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.162 1.385 . . . . 0.0 113.941 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.6 m -82.63 -12.14 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.91 164.58 26.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.389 1.475 . . . . 0.0 113.385 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 61.0 m -138.38 -54.99 0.63 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.861 1.665 . . . . 0.0 111.928 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.11 167.08 22.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.656 1.582 . . . . 0.0 112.643 -178.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -83.4 -4.65 58.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 2.5 t 56.27 35.28 25.52 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.76 2.024 . . . . 0.0 113.148 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 97.9 m -122.83 94.24 4.21 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 127.046 2.138 . . . . 0.0 109.486 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.5 144.46 88.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.487 1.115 . . . . 0.0 112.14 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -83.18 -6.56 11.14 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.965 3.11 . . . . 0.0 114.417 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt -128.37 160.07 33.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.913 2.085 . . . . 0.0 111.464 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1855 ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1859 ' ' LYS . . . . . 0.444 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t -67.99 -41.1 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 79.8 mt -68.57 -8.5 42.26 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.152 1.781 . . . . 0.0 114.401 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 95.98 16.42 38.6 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.792 1.187 . . . . 0.0 115.238 173.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.47 -22.0 66.83 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 118.923 1.362 . . . . 0.0 113.06 175.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 127.309 2.244 . . . . 0.0 112.27 -177.351 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 CA-C-O 119.8 -0.445 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -55.29 -29.77 69.01 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.628 3.552 . . . . 0.0 116.464 -173.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -122.59 9.56 9.27 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 125.734 1.635 . . . . 0.0 115.203 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.3 m -60.79 118.9 7.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.325 1.45 . . . . 0.0 113.316 -176.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -143.43 -60.02 0.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.643 1.177 . . . . 0.0 112.327 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.8 p30 -137.93 162.88 32.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 111.993 -179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -135.0 5.05 3.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.236 1.414 . . . . 0.0 113.972 -173.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.3 p -68.34 164.22 21.3 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.113 1.365 . . . . 0.0 113.422 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.6 m -77.57 -15.49 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -178.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -149.19 128.15 12.67 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.734 1.614 . . . . 0.0 111.928 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.5 t -64.34 -22.93 67.12 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.691 1.196 . . . . 0.0 114.21 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.28 -18.44 64.58 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -69.7 -6.17 29.93 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -176.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 94.3 p -128.59 3.69 5.55 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.102 1.761 . . . . 0.0 114.391 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 82.2 p -121.71 28.07 7.85 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 126.048 1.739 . . . . 0.0 113.402 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -54.36 147.63 27.26 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 126.122 1.769 . . . . 0.0 114.033 -176.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.44 -11.06 17.39 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.828 3.019 . . . . 0.0 114.986 -171.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt -133.08 162.14 32.53 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.241 1.816 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t -72.98 -49.92 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 71.4 mt -69.9 -20.89 63.35 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.725 1.61 . . . . 0.0 114.342 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 84.46 18.37 62.35 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.837 1.208 . . . . 0.0 114.899 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 59.95 -66.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.354 3.061 . . . . 0.0 115.85 -173.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.812 2.045 . . . . 0.0 113.915 -175.821 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 CA-C-O 119.716 -0.491 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.66 -12.11 18.41 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.844 3.029 . . . . 0.0 114.711 -175.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -72.63 164.61 54.69 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.573 1.082 . . . . 0.0 114.167 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 75.2 p -78.53 -15.26 58.78 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -73.82 109.5 7.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.729 2.012 . . . . 0.0 111.643 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 40.9 t30 -65.39 154.81 37.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.675 0.79 . . . . 0.0 112.12 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 54.6 t80 -63.58 -29.57 70.8 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 54.1 m -139.58 160.16 40.49 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.161 1.784 . . . . 0.0 112.252 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 5.3 p -75.27 -14.96 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.499 1.119 . . . . 0.0 113.881 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 57.9 17.52 4.36 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.508 2.723 . . . . 0.0 116.48 173.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 14.4 t -143.32 163.48 32.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.081 1.352 . . . . 0.0 112.542 176.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -99.26 -0.43 41.32 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.922 1.689 . . . . 0.0 112.41 166.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 10.6 tt0 61.44 20.31 11.05 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.086 2.155 . . . . 0.0 114.345 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 33.1 t -136.32 121.45 19.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.161 1.784 . . . . 0.0 111.345 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 65.9 p -131.41 9.23 4.7 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.935 1.694 . . . . 0.0 113.789 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.8 153.7 87.43 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.019 1.328 . . . . 0.0 113.06 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.57 -4.82 14.99 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 123.625 2.884 . . . . 0.0 114.263 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt -130.55 159.54 36.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.557 1.943 . . . . 0.0 111.674 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t -60.01 -44.18 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.7 mt -71.64 -12.13 61.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 113.754 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 74.05 16.16 79.63 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.6 1.095 . . . . 0.0 114.232 -174.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -84.31 -4.33 58.8 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.185 1.794 . . . . 0.0 113.438 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.937 1.695 . . . . 0.0 113.073 172.596 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 CA-C-O 119.763 -0.465 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.37 154.93 13.65 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.053 3.168 . . . . 0.0 114.767 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.37 -57.44 4.43 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.648 1.594 . . . . 0.0 113.398 -177.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 29.3 m -62.12 -14.42 36.69 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.856 1.662 . . . . 0.0 114.552 178.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.28 -19.15 7.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.447 2.299 . . . . 0.0 114.293 171.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -58.36 -15.79 11.96 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.6 t80 -141.42 159.89 41.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.805 1.242 . . . . 0.0 112.4 172.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 40.7 m -74.32 51.73 0.45 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 127.568 2.347 . . . . 0.0 113.601 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.0 m -62.04 -16.92 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.878 1.671 . . . . 0.0 115.273 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -76.76 -14.01 59.97 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -173.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 26.4 m -144.21 97.94 3.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.494 1.518 . . . . 0.0 111.202 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -89.22 -14.62 35.55 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -136.13 4.38 2.96 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -167.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 52.0 m 47.53 66.42 1.03 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.187 1.795 . . . . 0.0 112.536 -176.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 40.5 p -76.57 22.13 0.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.388 2.275 . . . . 0.0 116.146 -164.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -57.07 148.87 48.66 Favored Pre-proline 0 CA--C 1.552 1.05 0 O-C-N 120.037 -1.664 . . . . 0.0 112.902 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -73.74 -25.48 14.59 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.125 2.55 . . . . 0.0 113.832 -176.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt -139.14 163.63 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.34 1.456 . . . . 0.0 112.356 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t -64.22 -39.37 85.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.94 -18.1 64.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.569 1.548 . . . . 0.0 113.733 177.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 142.99 -1.12 1.44 Allowed Glycine 0 CA--C 1.534 1.273 0 N-CA-C 116.596 1.398 . . . . 0.0 116.596 167.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -71.62 -21.45 61.84 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.008 1.904 . . . . 0.0 114.014 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.088 1.355 . . . . 0.0 112.645 170.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.452 0 CA-C-O 119.622 -0.543 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.92 -19.88 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.142 3.228 . . . . 0.0 114.1 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 81.15 1.6 90.07 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.999 1.285 . . . . 0.0 115.624 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 43.2 m -128.96 9.22 5.76 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.029 1.732 . . . . 0.0 114.109 -174.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -143.32 172.71 12.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.569 1.948 . . . . 0.0 111.646 -174.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 58.9 t30 -74.3 61.06 0.86 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.492 1.517 . . . . 0.0 112.983 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.0 t80 -67.58 -17.23 64.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.62 1.568 . . . . 0.0 113.486 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 22.7 m -62.4 -12.3 20.73 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.932 1.693 . . . . 0.0 115.347 -175.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 33.7 m -60.1 -16.76 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.52 1.528 . . . . 0.0 114.09 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -71.02 -10.63 60.08 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.946 1.698 . . . . 0.0 114.623 169.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.8 m -130.27 -41.66 1.24 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.263 1.825 . . . . 0.0 112.211 -175.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.78 154.0 38.26 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.467 1.507 . . . . 0.0 112.884 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.22 112.26 1.85 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.885 1.274 . . . . 0.0 111.884 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 6.7 t -128.21 9.36 6.18 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.952 1.701 . . . . 0.0 113.226 -173.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.0 p -128.38 159.43 35.38 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.245 1.818 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -141.58 159.98 58.3 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.313 1.845 . . . . 0.0 111.557 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.4 -9.31 20.17 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.139 2.559 . . . . 0.0 113.983 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt -132.01 158.66 40.93 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.333 2.253 . . . . 0.0 110.319 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t -83.46 -43.7 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.95 -18.95 64.91 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.665 1.986 . . . . 0.0 113.263 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.42 22.41 56.59 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.951 1.263 . . . . 0.0 114.235 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -68.31 122.87 19.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.663 1.185 . . . . 0.0 111.679 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.255 1.368 0 C-N-CA 126.287 1.835 . . . . 0.0 112.186 -178.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 CA-C-O 119.521 -0.599 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.07 168.71 1.75 Allowed 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.85 3.7 . . . . 0.0 114.912 176.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 80.19 27.98 50.67 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.473 1.035 . . . . 0.0 114.697 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.4 m -56.89 -23.15 42.62 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.27 1.828 . . . . 0.0 115.657 -174.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -142.03 -50.74 0.39 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.036 1.335 . . . . 0.0 111.553 170.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -114.33 118.42 33.84 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.19 1.796 . . . . 0.0 109.976 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -65.04 -20.99 66.76 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.761 1.224 . . . . 0.0 114.156 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.6 m -80.05 57.21 2.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.28 1.432 . . . . 0.0 111.791 176.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 m -61.95 -15.98 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -78.69 -2.19 38.06 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.204 1.802 . . . . 0.0 114.836 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.1 t -62.68 156.54 23.25 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.296 1.438 . . . . 0.0 113.332 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 157.63 22.63 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.248 1.419 . . . . 0.0 112.802 -177.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -71.84 -16.38 62.16 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.746 1.619 . . . . 0.0 114.7 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 53.0 m -58.65 113.66 2.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.045 2.138 . . . . 0.0 113.696 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 61.1 p -139.18 172.97 12.06 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.542 2.337 . . . . 0.0 109.221 172.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -62.75 154.92 73.03 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.423 1.089 . . . . 0.0 112.951 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.71 -6.39 17.52 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.452 2.768 . . . . 0.0 114.328 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt -131.33 154.2 48.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.656 1.982 . . . . 0.0 111.047 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t -65.72 -44.67 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 76.6 mt -72.72 -16.07 61.67 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.903 1.681 . . . . 0.0 113.741 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 78.1 18.87 75.89 Favored Glycine 0 CA--C 1.541 1.682 0 C-N-CA 124.515 1.055 . . . . 0.0 114.064 -177.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -91.52 -0.11 57.57 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.078 1.751 . . . . 0.0 113.751 -173.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.256 1.419 0 C-N-CA 125.349 1.46 . . . . 0.0 113.299 178.152 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 CA-C-O 119.573 -0.57 . . . . 0.0 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.51 169.9 1.49 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.696 3.597 . . . . 0.0 115.3 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 87.89 -174.58 44.39 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.119 1.342 . . . . 0.0 113.806 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 8.5 t -140.27 169.21 18.09 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.549 1.539 . . . . 0.0 111.865 178.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -75.85 172.32 12.9 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.096 1.759 . . . . 0.0 112.85 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 29.5 t30 -54.38 -31.17 54.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.087 1.755 . . . . 0.0 114.358 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -75.9 -9.48 58.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.378 1.471 . . . . 0.0 114.504 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 77.4 p 35.05 65.65 0.36 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.623 2.769 . . . . 0.0 114.966 174.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.3 m -69.64 -7.9 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -173.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.81 168.07 6.72 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.952 1.701 . . . . 0.0 113.909 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 11.2 m -73.68 76.62 1.53 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.267 1.827 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -73.44 -23.02 60.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.776 1.63 . . . . 0.0 113.856 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.24 154.1 46.23 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.911 1.684 . . . . 0.0 111.802 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 70.5 m -140.45 172.84 12.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.65 1.58 . . . . 0.0 112.866 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 38.8 p -111.9 29.35 7.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.479 2.311 . . . . 0.0 112.977 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -54.54 146.55 33.73 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.205 1.802 . . . . 0.0 113.884 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -79.53 -4.32 13.51 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.816 3.011 . . . . 0.0 115.023 -173.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt -124.6 155.77 38.55 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.83 1.652 . . . . 0.0 111.695 -176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t -65.71 -42.54 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.45 -9.39 58.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.457 1.903 . . . . 0.0 114.175 176.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.86 13.32 75.32 Favored Glycine 0 CA--C 1.541 1.685 0 C-N-CA 124.939 1.257 . . . . 0.0 114.732 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.01 12.85 8.57 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.712 2.005 . . . . 0.0 113.519 -177.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 127.849 2.46 . . . . 0.0 114.073 176.629 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 CA-C-O 119.34 -0.7 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -72.92 -20.08 22.64 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.181 2.588 . . . . 0.0 114.343 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 76.4 -1.91 59.35 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.214 1.388 . . . . 0.0 115.557 178.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.8 p -64.19 -57.86 8.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.114 1.766 . . . . 0.0 112.196 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.93 -1.28 3.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.456 1.903 . . . . 0.0 113.75 177.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -73.58 -14.24 61.16 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 125.619 1.568 . . . . 0.0 114.552 -173.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.91 173.47 11.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.082 1.753 . . . . 0.0 112.097 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 83.9 p -143.63 177.54 8.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.96 1.704 . . . . 0.0 111.355 168.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.2 m -72.28 -13.85 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -88.13 143.33 27.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.231 1.412 . . . . 0.0 112.675 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 13.6 m -68.14 147.43 52.31 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.693 1.197 . . . . 0.0 110.364 169.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.63 164.89 13.43 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.691 0.758 . . . . 0.0 112.708 175.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -137.76 167.65 21.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.696 1.598 . . . . 0.0 111.688 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 7.8 t -124.58 177.64 5.84 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.908 1.683 . . . . 0.0 112.166 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 43.9 p -76.06 -1.87 28.02 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.6 133.36 92.69 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.892 1.677 . . . . 0.0 112.505 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.14 -8.94 16.57 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.056 3.171 . . . . 0.0 114.254 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -114.05 157.37 22.62 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.36 1.864 . . . . 0.0 111.463 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -73.15 -43.04 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.12 -15.25 63.6 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.14 1.776 . . . . 0.0 113.74 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 80.1 20.17 68.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.918 1.247 . . . . 0.0 113.673 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -99.58 2.49 44.71 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.603 1.561 . . . . 0.0 114.198 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.444 1.498 . . . . 0.0 113.382 173.971 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.76 174.88 10.43 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.116 3.211 . . . . 0.0 112.964 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -153.18 -178.27 27.58 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.66 1.6 . . . . 0.0 113.676 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.5 m -141.07 164.13 31.09 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.193 1.797 . . . . 0.0 111.746 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 44.9 80.62 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.478 2.311 . . . . 0.0 114.784 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 10.2 t-20 58.84 25.34 13.46 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.682 1.993 . . . . 0.0 115.234 172.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 21.4 p90 -59.86 -14.59 15.9 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.409 1.633 . . . . 0.0 115.409 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 47.0 m -71.79 68.99 0.65 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.206 1.802 . . . . 0.0 112.254 172.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 30.4 m -71.82 -6.93 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -174.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 54.43 24.94 5.6 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 126.812 2.045 . . . . 0.0 115.226 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.5 t -144.18 -173.92 4.14 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.09 2.156 . . . . 0.0 111.124 178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -57.72 152.58 15.19 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.618 1.567 . . . . 0.0 112.879 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.32 -7.39 52.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -177.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 69.9 m -139.35 155.39 47.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.725 2.01 . . . . 0.0 111.037 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 22.0 m -137.84 94.82 2.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.765 1.226 . . . . 0.0 111.092 -174.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.73 154.96 94.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.899 0.88 . . . . 0.0 111.896 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.92 -6.68 16.95 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.553 2.835 . . . . 0.0 113.9 -178.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt -130.39 156.95 43.87 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.958 2.103 . . . . 0.0 110.815 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t -80.99 -42.38 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.8 mt -73.56 -16.42 61.26 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.226 1.81 . . . . 0.0 114.156 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 86.44 12.51 69.78 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.861 1.22 . . . . 0.0 114.627 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -96.2 -2.46 46.2 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.173 1.789 . . . . 0.0 113.605 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.255 1.386 0 C-N-CA 126.599 1.96 . . . . 0.0 114.359 174.529 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 CA--C 1.545 0.779 0 CA-C-O 121.467 0.651 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.802 0.334 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 121.256 0.55 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1798 ' ' TRP . . . . . 0.404 ' CZ2' ' HB3' ' A' 1850 ' ' CYS . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1850 ' ' CYS . . . . . 0.404 ' HB3' ' CZ2' ' A' 1798 ' ' TRP . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.022 0.439 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 121.021 0.439 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.688 0.28 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1855 ' ' PHE . . . . . 0.41 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1859 ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 121.008 0.432 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.746 0.307 . . . . 0.0 111.464 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1855 ' ' PHE . . . . . 0.443 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1859 ' ' LYS . . . . . 0.443 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.981 0.419 . . . . 0.0 111.674 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.625 0.726 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 N--CA 1.47 0.554 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.136 0.493 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 111.695 0.258 . . . . 0.0 111.695 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.981 0.42 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 120.992 0.425 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.57 165.95 31.24 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.213 3.275 . . . . 0.0 112.792 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -90.91 -178.23 43.53 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.306 1.432 . . . . 0.0 113.772 175.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.5 m 57.36 28.33 15.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.973 1.709 . . . . 0.0 115.151 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . 0.274 11.6 pt-20 46.99 -65.83 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 130.858 3.663 . . . . 0.0 117.929 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.75 -31.67 72.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.649 1.58 . . . . 0.0 112.723 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 19.8 p90 50.53 -19.89 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 131.479 3.911 . . . . 0.0 119.151 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.6 t -82.48 176.57 9.3 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.8 1.64 . . . . 0.0 112.996 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 3.2 t -128.82 -6.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 127.117 2.167 . . . . 0.0 112.229 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -144.29 -175.35 4.59 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.103 1.761 . . . . 0.0 112.576 -174.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.6 t -137.69 175.04 9.94 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.16 1.784 . . . . 0.0 111.969 169.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -127.43 -5.99 5.89 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.074 1.75 . . . . 0.0 114.239 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -71.63 110.01 5.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.673 1.589 . . . . 0.0 112.123 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.2 m -65.46 159.3 24.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.161 1.385 . . . . 0.0 113.904 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 19.5 p -136.59 98.05 3.71 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.019 1.727 . . . . 0.0 111.147 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.98 158.6 61.64 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 125.95 1.7 . . . . 0.0 111.868 178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -78.37 -20.04 11.34 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.52 2.146 . . . . 0.0 114.216 -176.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt -88.86 166.45 13.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 0.0 112.4 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t -63.61 -42.65 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.52 -16.55 62.9 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.762 1.625 . . . . 0.0 113.397 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 75.46 15.86 80.96 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 124.863 1.221 . . . . 0.0 114.995 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -79.51 82.72 5.6 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.379 1.472 . . . . 0.0 112.004 -175.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.485 1.289 0 C-N-CA 127.1 2.16 . . . . 0.0 112.027 176.95 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.457 0 CA-C-O 119.413 -0.659 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.0 -17.44 17.43 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.011 3.141 . . . . 0.0 114.834 -177.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -78.91 166.77 52.19 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.09 1.329 . . . . 0.0 114.437 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 58.5 p -78.62 -8.52 58.73 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.925 1.69 . . . . 0.0 115.542 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 61.45 159.48 0.05 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 128.698 2.799 . . . . 0.0 114.624 -172.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -67.59 -23.88 65.44 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.422 -1.424 . . . . 0.0 113.968 -177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -143.35 159.78 41.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.271 1.029 . . . . 0.0 113.422 -174.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 20.5 m -82.84 15.79 2.53 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.816 2.046 . . . . 0.0 115.394 -170.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.4 m -65.35 -2.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 N-CA-C 116.798 2.147 . . . . 0.0 116.798 -170.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -56.21 139.1 48.89 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.73 1.212 . . . . 0.0 112.725 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 16.0 m -69.79 -33.96 73.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.456 1.503 . . . . 0.0 113.555 -171.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.92 173.41 11.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.325 1.45 . . . . 0.0 113.799 -172.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.62 149.63 36.07 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.226 1.81 . . . . 0.0 110.67 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 21.9 m -77.98 57.54 1.78 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.473 1.909 . . . . 0.0 113.857 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 63.4 p -80.21 4.69 16.73 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 126.186 1.795 . . . . 0.0 115.709 -176.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -65.37 148.01 98.27 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.839 1.656 . . . . 0.0 113.259 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -79.97 -6.59 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.132 3.221 . . . . 0.0 113.996 175.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt -124.86 161.2 27.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.891 2.077 . . . . 0.0 110.855 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t -68.56 -46.92 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 52.8 mt -71.4 -17.09 62.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.889 2.076 . . . . 0.0 113.758 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 76.91 16.36 80.84 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 124.574 1.083 . . . . 0.0 114.819 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -80.12 -16.58 54.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.716 1.206 . . . . 0.0 114.076 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 124.678 1.191 . . . . 0.0 112.795 170.602 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.518 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.78 165.93 31.39 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.663 2.909 . . . . 0.0 113.037 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -68.82 -12.62 64.99 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.863 1.221 . . . . 0.0 115.2 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 74.7 m -65.13 -15.52 62.49 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -108.89 -25.75 10.6 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.306 1.442 . . . . 0.0 113.55 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -135.28 96.4 3.47 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.011 1.724 . . . . 0.0 110.576 -175.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 53.9 p90 -144.95 171.95 13.73 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.442 1.497 . . . . 0.0 113.258 -175.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 8.6 t -142.79 176.46 9.04 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.403 1.881 . . . . 0.0 110.44 169.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 t -127.85 85.51 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.617 1.567 . . . . 0.0 109.533 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -74.47 -14.87 60.89 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . 0.257 2.5 t 46.66 -174.04 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 129.885 3.274 . . . . 0.0 115.347 -175.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.09 148.43 47.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.442 1.497 . . . . 0.0 112.344 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -152.68 133.04 13.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.27 1.428 . . . . 0.0 111.173 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 46.5 m -70.36 156.58 39.12 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.74 1.216 . . . . 0.0 113.086 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 49.4 p -132.26 5.92 4.14 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.19 141.27 88.67 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.473 1.109 . . . . 0.0 112.246 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.12 -10.05 15.19 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 123.348 2.698 . . . . 0.0 114.427 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt -131.47 159.73 37.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.501 1.92 . . . . 0.0 111.531 -173.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t -65.32 -41.91 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 49.3 mt -69.38 -12.55 61.75 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.135 1.774 . . . . 0.0 113.608 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.54 12.92 84.06 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.524 1.535 . . . . 0.0 114.546 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -80.91 -14.34 58.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.004 1.321 . . . . 0.0 114.004 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.251 1.147 0 C-N-CA 126.926 2.09 . . . . 0.0 112.273 -176.818 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.547 0 CA-C-O 119.882 -0.399 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.37 -18.09 18.24 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.904 3.07 . . . . 0.0 114.07 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.67 -16.1 8.7 Favored Glycine 0 CA--C 1.542 1.766 0 C-N-CA 125.873 1.701 . . . . 0.0 115.24 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 61.9 p -74.6 -14.71 60.81 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.901 1.68 . . . . 0.0 114.161 173.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -144.95 141.27 28.86 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.814 2.046 . . . . 0.0 110.771 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -147.57 147.1 29.72 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.42 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.35 -19.97 61.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.2 p -61.43 -13.25 18.85 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -170.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.0 m -60.09 -19.61 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.12 1.368 . . . . 0.0 113.598 168.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.06 -15.09 61.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.273 1.829 . . . . 0.0 114.346 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 86.8 m -95.32 -59.5 1.87 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.724 1.609 . . . . 0.0 110.208 174.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.45 156.17 38.95 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.997 1.319 . . . . 0.0 112.315 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.31 87.37 6.96 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.602 1.161 . . . . 0.0 111.311 174.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.4 p -67.0 -6.14 15.72 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.284 1.833 . . . . 0.0 115.402 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 13.1 p -75.33 65.18 1.61 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.814 2.446 . . . . 0.0 112.329 176.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -60.98 148.07 84.67 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 125.043 1.337 . . . . 0.0 113.117 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -84.77 -2.7 9.77 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.368 2.712 . . . . 0.0 115.517 -168.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -129.31 157.5 41.72 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.176 1.39 . . . . 0.0 112.218 -175.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1798 ' ' TRP . . . . . 0.404 ' CZ2' ' HB3' ' A' 1850 ' ' CYS . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1850 ' ' CYS . . . . . 0.404 ' HB3' ' CZ2' ' A' 1798 ' ' TRP . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t -82.66 -47.03 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.73 -34.92 78.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.957 1.303 . . . . 0.0 113.146 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 79.8 -6.24 59.35 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 126.499 2.0 . . . . 0.0 116.541 171.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.27 22.72 6.46 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 126.75 2.02 . . . . 0.0 114.451 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.921 2.088 . . . . 0.0 113.951 -178.999 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-O 119.089 -0.839 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.14 167.31 27.49 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.739 2.96 . . . . 0.0 113.282 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -155.62 23.79 0.56 Allowed Glycine 0 N--CA 1.475 1.279 0 C-N-CA 125.566 1.555 . . . . 0.0 114.451 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 15.1 m -62.76 -12.35 23.57 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -164.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.09 -39.77 60.24 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.875 1.67 . . . . 0.0 112.725 166.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 47.2 t30 -82.62 -14.65 54.38 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.223 1.409 . . . . 0.0 114.042 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -84.71 168.09 15.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.663 1.185 . . . . 0.0 112.849 -173.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 15.8 m -70.02 3.1 2.92 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.598 1.959 . . . . 0.0 115.703 -176.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.7 m -66.32 -12.34 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 126.187 1.795 . . . . 0.0 115.321 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -68.24 160.84 28.47 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.207 1.403 . . . . 0.0 113.316 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 10.8 t -74.24 166.02 24.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.827 0.851 . . . . 0.0 112.089 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -132.96 1.62 3.58 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.224 1.81 . . . . 0.0 113.717 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.92 153.05 46.84 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.758 1.223 . . . . 0.0 114.004 -175.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.1 m -147.23 88.57 1.73 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.328 2.251 . . . . 0.0 108.935 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.7 m -134.33 149.87 50.9 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.62 1.168 . . . . 0.0 112.084 -163.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -137.22 156.84 75.21 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.63 1.972 . . . . 0.0 111.044 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.66 -7.06 12.59 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.287 2.658 . . . . 0.0 115.708 -167.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt -129.59 166.7 19.21 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 112.067 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t -65.16 -35.8 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.36 -9.11 55.32 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.032 1.733 . . . . 0.0 114.71 174.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 117.79 11.66 8.36 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 125.452 1.501 . . . . 0.0 116.134 172.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.97 -4.11 0.85 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 128.617 2.767 . . . . 0.0 115.59 -176.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.334 2.254 . . . . 0.0 113.43 175.501 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.81 92.06 0.52 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.835 3.69 . . . . 0.0 111.876 -178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -144.04 11.95 2.1 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.709 1.623 . . . . 0.0 114.974 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.4 m -58.95 134.78 57.26 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 113.016 -175.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.35 4.58 2.67 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.285 1.434 . . . . 0.0 113.642 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -62.2 -18.91 62.41 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.453 1.501 . . . . 0.0 114.184 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 42.1 p90 -66.58 -15.64 63.58 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.225 1.41 . . . . 0.0 114.447 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 71.3 m -74.42 81.24 1.91 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.5 1.52 . . . . 0.0 112.516 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 58.4 t -65.79 113.97 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.591 1.556 . . . . 0.0 110.747 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -72.89 -175.7 1.82 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.112 1.365 . . . . 0.0 113.809 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 23.1 p -131.94 160.7 35.02 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.398 1.879 . . . . 0.0 112.528 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -78.1 145.78 35.57 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.014 1.325 . . . . 0.0 111.654 175.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -95.26 -7.22 39.48 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -176.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 25.6 m -74.25 -3.76 31.96 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.146 1.778 . . . . 0.0 114.417 -176.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 64.5 p -73.61 25.6 0.07 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 128.732 2.813 . . . . 0.0 115.094 -174.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -58.43 147.51 68.31 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.499 1.52 . . . . 0.0 113.401 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -79.45 -9.37 14.92 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.63 2.887 . . . . 0.0 114.576 -174.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt -133.52 156.07 48.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.938 2.095 . . . . 0.0 111.018 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t -67.95 -42.75 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.46 -9.13 52.34 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.884 1.673 . . . . 0.0 114.234 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 102.6 7.36 45.43 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.515 1.531 . . . . 0.0 115.393 171.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 62.9 -1.89 0.44 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.036 2.534 . . . . 0.0 116.484 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.652 1.981 . . . . 0.0 112.045 -176.963 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -56.75 -27.11 69.63 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.756 3.638 . . . . 0.0 115.959 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -177.56 -177.94 46.78 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 125.797 1.665 . . . . 0.0 113.09 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.4 t -144.6 170.34 16.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.514 1.526 . . . . 0.0 111.923 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.07 166.61 22.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.567 1.547 . . . . 0.0 113.507 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 1.4 t30 -78.06 76.07 4.58 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.671 1.189 . . . . 0.0 110.272 169.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.8 t80 -69.18 97.17 0.89 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.462 1.505 . . . . 0.0 112.236 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 55.4 m -142.56 147.61 36.19 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.641 1.576 . . . . 0.0 111.335 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 47.6 t -74.95 -34.97 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.195 0.998 . . . . 0.0 111.914 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.03 134.65 55.4 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.352 1.461 . . . . 0.0 111.597 173.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.8 t -150.77 159.67 44.38 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.783 1.233 . . . . 0.0 111.772 -177.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -61.42 -22.41 64.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.203 1.401 . . . . 0.0 113.137 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -72.51 -11.39 60.64 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.659 1.184 . . . . 0.0 114.179 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 38.4 m -135.24 -15.78 1.92 Allowed 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -169.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 6.3 t -155.48 169.83 23.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.747 1.219 . . . . 0.0 112.699 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.44 154.38 69.45 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 127.664 2.386 . . . . 0.0 110.768 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.27 -6.47 13.83 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.842 2.361 . . . . 0.0 114.87 -172.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt -132.17 156.72 45.92 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 111.917 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t -70.66 -49.12 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 56.5 mt -65.9 -24.47 66.85 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.922 1.689 . . . . 0.0 113.634 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 71.88 24.93 75.92 Favored Glycine 0 CA--C 1.539 1.547 0 C-N-CA 124.211 0.91 . . . . 0.0 113.607 -172.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -59.02 129.32 41.61 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.407 1.483 . . . . 0.0 111.722 -176.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.429 1.892 . . . . 0.0 112.505 -173.578 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.41 168.12 1.63 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.663 3.575 . . . . 0.0 115.471 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -77.19 96.7 1.24 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.333 1.444 . . . . 0.0 112.351 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 50.7 m -63.34 -16.68 61.12 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -173.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -138.61 114.44 9.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 111.521 176.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 31.0 t30 -68.37 -37.02 80.03 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.228 1.411 . . . . 0.0 113.754 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -70.72 154.51 41.78 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.119 1.155 . . . . 0.0 114.119 -164.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.7 p -137.45 -3.29 1.92 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . 0.262 26.1 m 45.58 28.13 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 128.305 2.642 . . . . 0.0 115.527 -175.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.76 172.46 3.5 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.465 1.506 . . . . 0.0 114.063 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.6 t -58.32 -22.49 53.28 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.688 1.595 . . . . 0.0 114.52 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -60.2 -18.96 51.95 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.028 1.331 . . . . 0.0 113.378 173.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.33 -17.68 62.43 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.152 1.381 . . . . 0.0 113.778 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.8 m -124.9 -6.49 7.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.553 1.541 . . . . 0.0 115.103 -169.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 5.3 t -74.68 167.2 22.26 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.426 1.09 . . . . 0.0 112.511 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -150.95 141.63 14.77 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.589 1.555 . . . . 0.0 112.128 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.68 -8.74 8.15 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.403 2.736 . . . . 0.0 114.906 -171.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt -130.0 159.72 35.85 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.339 1.856 . . . . 0.0 111.37 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1855 ' ' PHE . . . . . 0.41 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1859 ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t -63.94 -40.86 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 36.0 mt -71.12 -9.07 57.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.862 1.665 . . . . 0.0 113.827 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 82.54 8.41 86.19 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.505 1.526 . . . . 0.0 114.667 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.37 -19.01 47.34 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.277 1.431 . . . . 0.0 113.395 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.252 1.217 0 C-N-CA 127.144 2.178 . . . . 0.0 112.317 179.168 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 CA-C-O 119.717 -0.491 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -58.25 -21.32 51.62 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.669 3.579 . . . . 0.0 116.133 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 91.52 -6.16 80.35 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 125.184 1.373 . . . . 0.0 114.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.3 t -68.32 152.86 44.83 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.025 0.93 . . . . 0.0 111.589 170.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.84 -18.32 59.6 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.164 -0.96 . . . . 0.0 113.567 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.72 -33.85 75.96 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.372 1.069 . . . . 0.0 112.548 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 65.2 t80 -70.78 -35.68 72.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.852 0.861 . . . . 0.0 111.777 173.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 16.0 m -67.39 -9.01 37.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.874 1.67 . . . . 0.0 114.943 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 90.6 t -61.25 -19.67 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 126.089 1.756 . . . . 0.0 112.589 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.31 -7.66 10.28 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.189 1.796 . . . . 0.0 115.275 171.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 47.7 m -131.51 151.66 51.38 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.286 2.234 . . . . 0.0 110.604 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 66.65 -44.37 0.43 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 129.006 2.922 . . . . 0.0 114.669 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.62 2.64 0.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 128.063 2.545 . . . . 0.0 117.528 162.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 22.6 t -149.5 160.08 43.76 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.793 1.237 . . . . 0.0 112.797 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 70.9 p -131.04 4.75 4.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.265 2.226 . . . . 0.0 112.596 173.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -94.89 158.04 35.72 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.915 1.686 . . . . 0.0 113.456 -171.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.41 -5.75 15.83 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 123.978 3.118 . . . . 0.0 114.452 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt -125.16 155.68 39.58 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.111 2.164 . . . . 0.0 110.75 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t -69.19 -39.06 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 83.4 mt -71.22 -11.29 60.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.686 1.594 . . . . 0.0 114.08 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.53 18.49 77.62 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.061 1.315 . . . . 0.0 114.904 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -102.75 88.24 3.16 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.316 1.847 . . . . 0.0 111.478 -171.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 46.4 p . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.641 1.576 . . . . 0.0 114.616 174.461 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.284 -0.731 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -55.43 173.15 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 125.239 3.96 . . . . 0.0 114.889 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -60.21 -15.14 36.12 Favored Glycine 0 CA--C 1.54 1.644 0 C-N-CA 124.626 1.107 . . . . 0.0 115.648 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.5 p -66.31 -9.75 36.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.088 1.755 . . . . 0.0 114.582 171.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -58.66 -33.07 69.69 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.88 1.672 . . . . 0.0 113.205 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.01 118.71 6.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.998 1.719 . . . . 0.0 113.357 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 43.3 p90 -70.99 -2.21 14.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.239 1.416 . . . . 0.0 113.702 166.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.0 m -59.58 -8.79 2.11 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.253 2.621 . . . . 0.0 116.539 -170.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 32.8 m -60.04 -12.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.619 1.968 . . . . 0.0 114.46 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -70.61 -6.51 37.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.408 1.883 . . . . 0.0 114.992 172.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.9 p -123.44 177.7 5.51 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.777 1.631 . . . . 0.0 113.389 -172.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -130.9 138.52 49.83 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.184 1.793 . . . . 0.0 111.73 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -75.62 -13.89 60.35 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.045 1.338 . . . . 0.0 114.53 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 3.5 t 64.23 -13.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 128.37 2.668 . . . . 0.0 116.04 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 3.8 m 47.04 58.16 5.05 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.592 2.757 . . . . 0.0 113.55 169.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.12 153.21 96.27 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 120.973 -1.079 . . . . 0.0 111.39 167.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.55 -20.22 18.21 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.765 2.31 . . . . 0.0 113.947 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt -134.52 152.65 51.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.036 1.734 . . . . 0.0 111.649 -176.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -59.82 -46.01 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.21 -14.38 62.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.658 1.583 . . . . 0.0 113.511 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 68.5 18.99 72.35 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 124.83 1.205 . . . . 0.0 114.014 -175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -84.78 68.79 10.58 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.165 1.386 . . . . 0.0 111.573 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.723 2.009 . . . . 0.0 113.475 -179.336 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.588 0 CA-C-O 118.154 -1.359 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -54.18 157.16 11.66 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.462 3.442 . . . . 0.0 114.814 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -103.42 15.91 53.19 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 126.197 1.856 . . . . 0.0 115.075 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 23.6 m -54.26 142.81 24.99 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.185 1.794 . . . . 0.0 113.567 -173.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -67.07 168.17 10.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.765 1.226 . . . . 0.0 113.698 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.27 173.37 15.1 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.934 1.694 . . . . 0.0 111.526 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -177.34 0.38 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.457 1.103 . . . . 0.0 113.009 164.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 18.5 t -66.56 98.08 0.48 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.912 -1.117 . . . . 0.0 111.145 170.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.2 m -71.53 -10.92 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.796 1.638 . . . . 0.0 114.555 -176.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.88 153.16 42.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.964 1.306 . . . . 0.0 112.841 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.2 m -64.64 126.65 28.58 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.128 1.371 . . . . 0.0 110.968 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -70.85 -9.61 57.93 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -127.83 118.81 24.39 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.383 1.873 . . . . 0.0 110.656 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 24.5 m -72.69 -2.37 19.93 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.91 1.684 . . . . 0.0 115.346 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 56.6 p 41.67 57.63 3.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.684 2.393 . . . . 0.0 113.978 -177.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -62.94 151.99 84.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.382 1.473 . . . . 0.0 113.243 -175.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.53 -4.83 15.03 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.039 3.159 . . . . 0.0 114.733 -174.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt -126.07 153.67 44.14 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.448 1.499 . . . . 0.0 112.463 -172.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t -85.92 -44.43 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.62 -16.0 63.3 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.172 1.789 . . . . 0.0 113.5 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 91.12 13.44 58.87 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.518 1.532 . . . . 0.0 114.364 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -81.9 7.09 13.84 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.088 1.355 . . . . 0.0 113.832 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.256 1.439 0 C-N-CA 128.232 2.613 . . . . 0.0 114.385 177.363 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.342 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -56.06 -22.09 37.61 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 124.461 3.441 . . . . 0.0 116.991 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -80.45 60.78 4.51 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.638 1.589 . . . . 0.0 113.673 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -74.25 61.19 0.86 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 112.9 176.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.96 -3.22 18.27 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.34 1.856 . . . . 0.0 114.885 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.95 164.56 2.84 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.394 1.878 . . . . 0.0 114.147 175.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 70.8 t80 -65.35 159.68 23.51 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.666 1.187 . . . . 0.0 112.412 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 25.2 m -67.11 157.16 34.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.162 1.385 . . . . 0.0 113.941 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.6 m -82.63 -12.14 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.91 164.58 26.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.389 1.475 . . . . 0.0 113.385 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 61.0 m -138.38 -54.99 0.63 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.861 1.665 . . . . 0.0 111.928 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.11 167.08 22.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.656 1.582 . . . . 0.0 112.643 -178.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -83.4 -4.65 58.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 2.5 t 56.27 35.28 25.52 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.76 2.024 . . . . 0.0 113.148 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 97.9 m -122.83 94.24 4.21 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 127.046 2.138 . . . . 0.0 109.486 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.5 144.46 88.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.487 1.115 . . . . 0.0 112.14 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -83.18 -6.56 11.14 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.965 3.11 . . . . 0.0 114.417 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt -128.37 160.07 33.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.913 2.085 . . . . 0.0 111.464 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1855 ' ' PHE . . . . . 0.443 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1859 ' ' LYS . . . . . 0.443 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t -67.99 -41.1 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 79.8 mt -68.57 -8.5 42.26 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.152 1.781 . . . . 0.0 114.401 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 95.98 16.42 38.6 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.792 1.187 . . . . 0.0 115.238 173.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.47 -22.0 66.83 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 118.923 1.362 . . . . 0.0 113.06 175.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 127.309 2.244 . . . . 0.0 112.27 -177.351 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 CA-C-O 119.8 -0.445 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -55.29 -29.77 69.01 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.628 3.552 . . . . 0.0 116.464 -173.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -122.59 9.56 9.27 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 125.734 1.635 . . . . 0.0 115.203 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.3 m -60.79 118.9 7.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.325 1.45 . . . . 0.0 113.316 -176.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -143.43 -60.02 0.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.643 1.177 . . . . 0.0 112.327 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.8 p30 -137.93 162.88 32.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 111.993 -179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -135.0 5.05 3.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.236 1.414 . . . . 0.0 113.972 -173.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.3 p -68.34 164.22 21.3 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.113 1.365 . . . . 0.0 113.422 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.6 m -77.57 -15.49 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -178.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -149.19 128.15 12.67 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.734 1.614 . . . . 0.0 111.928 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.5 t -64.34 -22.93 67.12 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.691 1.196 . . . . 0.0 114.21 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.28 -18.44 64.58 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -69.7 -6.17 29.93 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -176.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 94.3 p -128.59 3.69 5.55 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.102 1.761 . . . . 0.0 114.391 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 82.2 p -121.71 28.07 7.85 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 126.048 1.739 . . . . 0.0 113.402 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -54.36 147.63 27.26 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 126.122 1.769 . . . . 0.0 114.033 -176.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.44 -11.06 17.39 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.828 3.019 . . . . 0.0 114.986 -171.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt -133.08 162.14 32.53 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.241 1.816 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t -72.98 -49.92 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 71.4 mt -69.9 -20.89 63.35 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.725 1.61 . . . . 0.0 114.342 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 84.46 18.37 62.35 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.837 1.208 . . . . 0.0 114.899 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 59.95 -66.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.354 3.061 . . . . 0.0 115.85 -173.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.812 2.045 . . . . 0.0 113.915 -175.821 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 CA-C-O 119.716 -0.491 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.66 -12.11 18.41 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.844 3.029 . . . . 0.0 114.711 -175.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -72.63 164.61 54.69 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.573 1.082 . . . . 0.0 114.167 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 75.2 p -78.53 -15.26 58.78 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -73.82 109.5 7.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.729 2.012 . . . . 0.0 111.643 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 40.9 t30 -65.39 154.81 37.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.675 0.79 . . . . 0.0 112.12 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 54.6 t80 -63.58 -29.57 70.8 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 54.1 m -139.58 160.16 40.49 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.161 1.784 . . . . 0.0 112.252 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 5.3 p -75.27 -14.96 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.499 1.119 . . . . 0.0 113.881 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 57.9 17.52 4.36 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.508 2.723 . . . . 0.0 116.48 173.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 14.4 t -143.32 163.48 32.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.081 1.352 . . . . 0.0 112.542 176.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -99.26 -0.43 41.32 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.922 1.689 . . . . 0.0 112.41 166.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 10.6 tt0 61.44 20.31 11.05 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.086 2.155 . . . . 0.0 114.345 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 33.1 t -136.32 121.45 19.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.161 1.784 . . . . 0.0 111.345 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 65.9 p -131.41 9.23 4.7 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.935 1.694 . . . . 0.0 113.789 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.8 153.7 87.43 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.019 1.328 . . . . 0.0 113.06 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.57 -4.82 14.99 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 123.625 2.884 . . . . 0.0 114.263 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt -130.55 159.54 36.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.557 1.943 . . . . 0.0 111.674 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t -60.01 -44.18 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.7 mt -71.64 -12.13 61.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 113.754 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 74.05 16.16 79.63 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.6 1.095 . . . . 0.0 114.232 -174.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -84.31 -4.33 58.8 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.185 1.794 . . . . 0.0 113.438 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.937 1.695 . . . . 0.0 113.073 172.596 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 CA-C-O 119.763 -0.465 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.37 154.93 13.65 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.053 3.168 . . . . 0.0 114.767 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.37 -57.44 4.43 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.648 1.594 . . . . 0.0 113.398 -177.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 29.3 m -62.12 -14.42 36.69 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.856 1.662 . . . . 0.0 114.552 178.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.28 -19.15 7.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.447 2.299 . . . . 0.0 114.293 171.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -58.36 -15.79 11.96 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.6 t80 -141.42 159.89 41.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.805 1.242 . . . . 0.0 112.4 172.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 40.7 m -74.32 51.73 0.45 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 127.568 2.347 . . . . 0.0 113.601 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.0 m -62.04 -16.92 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.878 1.671 . . . . 0.0 115.273 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -76.76 -14.01 59.97 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -173.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 26.4 m -144.21 97.94 3.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.494 1.518 . . . . 0.0 111.202 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -89.22 -14.62 35.55 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -136.13 4.38 2.96 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -167.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 52.0 m 47.53 66.42 1.03 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.187 1.795 . . . . 0.0 112.536 -176.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 40.5 p -76.57 22.13 0.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.388 2.275 . . . . 0.0 116.146 -164.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -57.07 148.87 48.66 Favored Pre-proline 0 CA--C 1.552 1.05 0 O-C-N 120.037 -1.664 . . . . 0.0 112.902 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -73.74 -25.48 14.59 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.125 2.55 . . . . 0.0 113.832 -176.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt -139.14 163.63 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.34 1.456 . . . . 0.0 112.356 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t -64.22 -39.37 85.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.94 -18.1 64.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.569 1.548 . . . . 0.0 113.733 177.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 142.99 -1.12 1.44 Allowed Glycine 0 CA--C 1.534 1.273 0 N-CA-C 116.596 1.398 . . . . 0.0 116.596 167.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -71.62 -21.45 61.84 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.008 1.904 . . . . 0.0 114.014 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.088 1.355 . . . . 0.0 112.645 170.872 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.452 0 CA-C-O 119.622 -0.543 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.92 -19.88 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.142 3.228 . . . . 0.0 114.1 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 81.15 1.6 90.07 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.999 1.285 . . . . 0.0 115.624 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 43.2 m -128.96 9.22 5.76 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.029 1.732 . . . . 0.0 114.109 -174.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -143.32 172.71 12.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.569 1.948 . . . . 0.0 111.646 -174.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 58.9 t30 -74.3 61.06 0.86 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.492 1.517 . . . . 0.0 112.983 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.0 t80 -67.58 -17.23 64.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.62 1.568 . . . . 0.0 113.486 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 22.7 m -62.4 -12.3 20.73 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.932 1.693 . . . . 0.0 115.347 -175.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 33.7 m -60.1 -16.76 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.52 1.528 . . . . 0.0 114.09 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -71.02 -10.63 60.08 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.946 1.698 . . . . 0.0 114.623 169.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.8 m -130.27 -41.66 1.24 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.263 1.825 . . . . 0.0 112.211 -175.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.78 154.0 38.26 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.467 1.507 . . . . 0.0 112.884 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.22 112.26 1.85 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.885 1.274 . . . . 0.0 111.884 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 6.7 t -128.21 9.36 6.18 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.952 1.701 . . . . 0.0 113.226 -173.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.0 p -128.38 159.43 35.38 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.245 1.818 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -141.58 159.98 58.3 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.313 1.845 . . . . 0.0 111.557 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.4 -9.31 20.17 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.139 2.559 . . . . 0.0 113.983 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt -132.01 158.66 40.93 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.333 2.253 . . . . 0.0 110.319 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t -83.46 -43.7 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.95 -18.95 64.91 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.665 1.986 . . . . 0.0 113.263 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.42 22.41 56.59 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.951 1.263 . . . . 0.0 114.235 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -68.31 122.87 19.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.663 1.185 . . . . 0.0 111.679 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.255 1.368 0 C-N-CA 126.287 1.835 . . . . 0.0 112.186 -178.937 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 CA-C-O 119.521 -0.599 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.07 168.71 1.75 Allowed 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.85 3.7 . . . . 0.0 114.912 176.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 80.19 27.98 50.67 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.473 1.035 . . . . 0.0 114.697 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.4 m -56.89 -23.15 42.62 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.27 1.828 . . . . 0.0 115.657 -174.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -142.03 -50.74 0.39 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.036 1.335 . . . . 0.0 111.553 170.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -114.33 118.42 33.84 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.19 1.796 . . . . 0.0 109.976 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -65.04 -20.99 66.76 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.761 1.224 . . . . 0.0 114.156 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.6 m -80.05 57.21 2.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.28 1.432 . . . . 0.0 111.791 176.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 m -61.95 -15.98 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -78.69 -2.19 38.06 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.204 1.802 . . . . 0.0 114.836 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.1 t -62.68 156.54 23.25 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.296 1.438 . . . . 0.0 113.332 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 157.63 22.63 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.248 1.419 . . . . 0.0 112.802 -177.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -71.84 -16.38 62.16 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.746 1.619 . . . . 0.0 114.7 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 53.0 m -58.65 113.66 2.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.045 2.138 . . . . 0.0 113.696 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 61.1 p -139.18 172.97 12.06 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.542 2.337 . . . . 0.0 109.221 172.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -62.75 154.92 73.03 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.423 1.089 . . . . 0.0 112.951 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.71 -6.39 17.52 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.452 2.768 . . . . 0.0 114.328 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt -131.33 154.2 48.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.656 1.982 . . . . 0.0 111.047 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t -65.72 -44.67 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 76.6 mt -72.72 -16.07 61.67 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.903 1.681 . . . . 0.0 113.741 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 78.1 18.87 75.89 Favored Glycine 0 CA--C 1.541 1.682 0 C-N-CA 124.515 1.055 . . . . 0.0 114.064 -177.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -91.52 -0.11 57.57 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.078 1.751 . . . . 0.0 113.751 -173.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.256 1.419 0 C-N-CA 125.349 1.46 . . . . 0.0 113.299 178.152 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 CA-C-O 119.573 -0.57 . . . . 0.0 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.51 169.9 1.49 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.696 3.597 . . . . 0.0 115.3 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 87.89 -174.58 44.39 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.119 1.342 . . . . 0.0 113.806 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 8.5 t -140.27 169.21 18.09 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.549 1.539 . . . . 0.0 111.865 178.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -75.85 172.32 12.9 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.096 1.759 . . . . 0.0 112.85 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 29.5 t30 -54.38 -31.17 54.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.087 1.755 . . . . 0.0 114.358 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -75.9 -9.48 58.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.378 1.471 . . . . 0.0 114.504 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 77.4 p 35.05 65.65 0.36 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.623 2.769 . . . . 0.0 114.966 174.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.3 m -69.64 -7.9 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -173.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.81 168.07 6.72 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.952 1.701 . . . . 0.0 113.909 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 11.2 m -73.68 76.62 1.53 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.267 1.827 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -73.44 -23.02 60.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.776 1.63 . . . . 0.0 113.856 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.24 154.1 46.23 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.911 1.684 . . . . 0.0 111.802 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 70.5 m -140.45 172.84 12.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.65 1.58 . . . . 0.0 112.866 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 38.8 p -111.9 29.35 7.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.479 2.311 . . . . 0.0 112.977 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -54.54 146.55 33.73 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.205 1.802 . . . . 0.0 113.884 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -79.53 -4.32 13.51 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.816 3.011 . . . . 0.0 115.023 -173.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt -124.6 155.77 38.55 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.83 1.652 . . . . 0.0 111.695 -176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t -65.71 -42.54 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.45 -9.39 58.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.457 1.903 . . . . 0.0 114.175 176.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.86 13.32 75.32 Favored Glycine 0 CA--C 1.541 1.685 0 C-N-CA 124.939 1.257 . . . . 0.0 114.732 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.01 12.85 8.57 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.712 2.005 . . . . 0.0 113.519 -177.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 127.849 2.46 . . . . 0.0 114.073 176.629 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 CA-C-O 119.34 -0.7 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -72.92 -20.08 22.64 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.181 2.588 . . . . 0.0 114.343 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 76.4 -1.91 59.35 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.214 1.388 . . . . 0.0 115.557 178.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.8 p -64.19 -57.86 8.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.114 1.766 . . . . 0.0 112.196 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.93 -1.28 3.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.456 1.903 . . . . 0.0 113.75 177.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -73.58 -14.24 61.16 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 125.619 1.568 . . . . 0.0 114.552 -173.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.91 173.47 11.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.082 1.753 . . . . 0.0 112.097 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 83.9 p -143.63 177.54 8.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.96 1.704 . . . . 0.0 111.355 168.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.2 m -72.28 -13.85 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -88.13 143.33 27.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.231 1.412 . . . . 0.0 112.675 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 13.6 m -68.14 147.43 52.31 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.693 1.197 . . . . 0.0 110.364 169.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.63 164.89 13.43 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.691 0.758 . . . . 0.0 112.708 175.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -137.76 167.65 21.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.696 1.598 . . . . 0.0 111.688 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 7.8 t -124.58 177.64 5.84 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.908 1.683 . . . . 0.0 112.166 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 43.9 p -76.06 -1.87 28.02 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.6 133.36 92.69 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.892 1.677 . . . . 0.0 112.505 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.14 -8.94 16.57 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.056 3.171 . . . . 0.0 114.254 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -114.05 157.37 22.62 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.36 1.864 . . . . 0.0 111.463 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -73.15 -43.04 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.12 -15.25 63.6 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.14 1.776 . . . . 0.0 113.74 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 80.1 20.17 68.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.918 1.247 . . . . 0.0 113.673 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -99.58 2.49 44.71 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.603 1.561 . . . . 0.0 114.198 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.444 1.498 . . . . 0.0 113.382 173.971 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.76 174.88 10.43 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.116 3.211 . . . . 0.0 112.964 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -153.18 -178.27 27.58 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.66 1.6 . . . . 0.0 113.676 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.5 m -141.07 164.13 31.09 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.193 1.797 . . . . 0.0 111.746 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 44.9 80.62 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.478 2.311 . . . . 0.0 114.784 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 10.2 t-20 58.84 25.34 13.46 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.682 1.993 . . . . 0.0 115.234 172.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 21.4 p90 -59.86 -14.59 15.9 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.409 1.633 . . . . 0.0 115.409 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 47.0 m -71.79 68.99 0.65 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.206 1.802 . . . . 0.0 112.254 172.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 30.4 m -71.82 -6.93 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -174.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 54.43 24.94 5.6 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 126.812 2.045 . . . . 0.0 115.226 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.5 t -144.18 -173.92 4.14 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.09 2.156 . . . . 0.0 111.124 178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -57.72 152.58 15.19 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.618 1.567 . . . . 0.0 112.879 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.32 -7.39 52.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -177.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 69.9 m -139.35 155.39 47.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.725 2.01 . . . . 0.0 111.037 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 22.0 m -137.84 94.82 2.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.765 1.226 . . . . 0.0 111.092 -174.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.73 154.96 94.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.899 0.88 . . . . 0.0 111.896 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.92 -6.68 16.95 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.553 2.835 . . . . 0.0 113.9 -178.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt -130.39 156.95 43.87 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.958 2.103 . . . . 0.0 110.815 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t -80.99 -42.38 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.8 mt -73.56 -16.42 61.26 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.226 1.81 . . . . 0.0 114.156 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 86.44 12.51 69.78 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.861 1.22 . . . . 0.0 114.627 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -96.2 -2.46 46.2 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.173 1.789 . . . . 0.0 113.605 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.255 1.386 0 C-N-CA 126.599 1.96 . . . . 0.0 114.359 174.529 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 CA--C 1.545 0.779 0 CA-C-O 121.467 0.651 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.802 0.334 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 121.256 0.55 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . 0.404 ' CZ2' ' HB3' ' A' 1850 ' ' CYS . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . 0.404 ' HB3' ' CZ2' ' A' 1798 ' ' TRP . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.022 0.439 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 121.021 0.439 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.688 0.28 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . 0.41 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 121.008 0.432 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.746 0.307 . . . . 0.0 111.464 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . 0.443 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . 0.443 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.981 0.419 . . . . 0.0 111.674 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.625 0.726 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 N--CA 1.47 0.554 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.136 0.493 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 111.695 0.258 . . . . 0.0 111.695 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.981 0.42 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 120.992 0.425 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.57 165.95 31.24 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.213 3.275 . . . . 0.0 112.792 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -90.91 -178.23 43.53 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.306 1.432 . . . . 0.0 113.772 175.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.5 m 57.36 28.33 15.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.973 1.709 . . . . 0.0 115.151 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . 0.274 11.6 pt-20 46.99 -65.83 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 130.858 3.663 . . . . 0.0 117.929 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.75 -31.67 72.78 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.649 1.58 . . . . 0.0 112.723 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 19.8 p90 50.53 -19.89 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 131.479 3.911 . . . . 0.0 119.151 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.6 t -82.48 176.57 9.3 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.8 1.64 . . . . 0.0 112.996 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 3.2 t -128.82 -6.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 127.117 2.167 . . . . 0.0 112.229 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -144.29 -175.35 4.59 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.103 1.761 . . . . 0.0 112.576 -174.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.6 t -137.69 175.04 9.94 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.16 1.784 . . . . 0.0 111.969 169.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -127.43 -5.99 5.89 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.074 1.75 . . . . 0.0 114.239 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -71.63 110.01 5.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.673 1.589 . . . . 0.0 112.123 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.2 m -65.46 159.3 24.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.161 1.385 . . . . 0.0 113.904 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 19.5 p -136.59 98.05 3.71 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.019 1.727 . . . . 0.0 111.147 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.98 158.6 61.64 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 125.95 1.7 . . . . 0.0 111.868 178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -78.37 -20.04 11.34 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.52 2.146 . . . . 0.0 114.216 -176.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 88.0 mt -88.86 166.45 13.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 0.0 112.4 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 65.0 p -139.39 173.86 11.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.057 1.743 . . . . 0.0 112.498 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.96 -34.72 65.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.784 1.234 . . . . 0.0 112.594 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.74 -32.47 73.61 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.746 1.218 . . . . 0.0 113.229 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -65.85 -47.25 75.58 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.387 -0.82 . . . . 0.0 111.96 175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -66.23 -42.13 89.09 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.975 0.91 . . . . 0.0 112.023 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.61 -47.57 81.82 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.876 0.87 . . . . 0.0 112.106 173.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -58.17 -46.11 86.3 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.88 1.272 . . . . 0.0 112.084 172.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.0 t80 -55.62 -52.76 62.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.062 0.846 . . . . 0.0 112.313 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -66.62 -33.42 75.63 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.804 1.039 . . . . 0.0 113.804 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -61.17 -49.15 78.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.214 -0.929 . . . . 0.0 111.994 173.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.78 -35.14 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.175 0.99 . . . . 0.0 112.26 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -54.66 -42.03 70.83 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.834 1.254 . . . . 0.0 112.825 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -59.81 -21.74 61.27 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.257 1.423 . . . . 0.0 113.875 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.2 mttm -72.18 -21.37 61.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.589 1.156 . . . . 0.0 113.532 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -115.07 -24.54 8.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.004 1.722 . . . . 0.0 113.44 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 17.1 t0 -127.58 70.4 76.56 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.349 1.859 . . . . 0.0 110.758 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.78 -18.92 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.865 2.377 . . . . 0.0 112.313 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -76.25 -7.99 56.09 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.121 1.768 . . . . 0.0 113.473 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.15 27.79 10.07 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.873 2.069 . . . . 0.0 114.507 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 66.2 p -64.17 -16.22 61.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.94 1.696 . . . . 0.0 114.429 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 71.4 16.97 5.92 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.537 2.335 . . . . 0.0 113.792 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -129.19 150.39 50.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.035 0.934 . . . . 0.0 112.865 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 47.9 pt -137.07 161.72 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.399 1.48 . . . . 0.0 110.624 163.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -78.59 150.96 32.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.238 1.015 . . . . 0.0 112.393 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.1 t80 -60.67 -27.13 67.6 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.284 -0.885 . . . . 0.0 112.355 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.97 -16.61 63.57 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.107 1.763 . . . . 0.0 114.617 174.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.95 -6.89 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 125.284 1.433 . . . . 0.0 113.368 176.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.31 -34.38 66.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.051 1.341 . . . . 0.0 112.322 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 25.2 p -72.65 -35.37 67.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.193 1.397 . . . . 0.0 113.124 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -69.51 -43.27 73.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.07 0.948 . . . . 0.0 111.709 169.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.66 -49.51 77.27 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.0 0.92 . . . . 0.0 112.045 172.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.17 -34.84 61.45 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.06 1.344 . . . . 0.0 113.367 175.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -88.95 -6.8 57.0 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.918 1.287 . . . . 0.0 114.368 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.16 -18.72 24.0 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.54 -1.35 . . . . 0.0 112.95 -177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.8 mt -72.56 161.47 30.74 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.153 1.781 . . . . 0.0 112.077 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 74.8 m -83.76 158.1 21.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.727 0.775 . . . . 0.0 110.608 162.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.15 149.41 82.37 Favored Pre-proline 0 CA--C 1.554 1.105 0 O-C-N 121.207 -0.933 . . . . 0.0 111.202 169.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -83.71 -11.77 41.75 Favored 'Cis proline' 0 CA--C 1.541 0.867 0 N-CA-C 114.857 1.06 . . . . 0.0 114.857 0.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.13 -21.43 65.83 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.593 1.088 . . . . 0.0 113.74 -175.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -52.34 140.98 20.54 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.523 2.329 . . . . 0.0 112.657 169.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.82 98.71 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 126.022 1.729 . . . . 0.0 107.042 159.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.71 128.82 38.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.104 0.961 . . . . 0.0 112.679 -172.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -60.08 139.8 90.95 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.239 1.416 . . . . 0.0 111.418 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.07 129.29 15.59 Favored 'Cis proline' 0 C--N 1.355 0.892 0 CA-C-N 120.166 1.095 . . . . 0.0 112.921 -2.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.7 p30 -124.96 -2.76 7.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.188 1.395 . . . . 0.0 114.543 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -56.28 -39.28 72.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.19 -42.82 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.489 1.116 . . . . 0.0 110.696 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 11.1 t -59.26 -51.33 70.43 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.784 0.834 . . . . 0.0 110.941 174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.37 -42.7 82.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.386 1.074 . . . . 0.0 112.703 176.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 57.0 mt -61.87 -36.06 71.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.346 1.058 . . . . 0.0 111.937 175.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -80.22 -14.93 58.04 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 68.1 mtt -71.42 156.55 39.34 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.041 1.292 . . . . 0.0 111.122 170.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.39 24.5 0.82 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.619 1.968 . . . . 0.0 113.878 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 36.7 mt -50.01 129.7 22.44 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 126.398 1.879 . . . . 0.0 112.459 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -77.28 -178.12 4.35 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.204 2.602 . . . . 0.0 111.891 172.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 59.7 mtt -135.99 149.53 48.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.908 1.283 . . . . 0.0 110.058 159.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.5 m -96.95 -15.45 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.161 0.985 . . . . 0.0 113.518 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 79.9 p -138.45 -10.98 1.41 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.934 2.094 . . . . 0.0 114.329 -173.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.26 0.5 82.62 Favored Glycine 0 CA--C 1.541 1.711 0 C-N-CA 124.968 1.27 . . . . 0.0 114.917 -162.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.9 p30 -147.86 -12.15 0.38 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 174.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -118.65 160.14 22.36 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 177.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -135.54 144.28 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 126.407 1.883 . . . . 0.0 109.787 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -82.28 140.64 33.5 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.292 1.437 . . . . 0.0 113.276 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.7 t -46.19 -55.86 6.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.897 2.479 . . . . 0.0 114.27 -177.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -64.75 -33.51 76.15 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.555 -0.715 . . . . 0.0 112.655 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.55 -35.64 63.09 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.375 -0.828 . . . . 0.0 111.957 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.06 -53.13 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.614 1.166 . . . . 0.0 109.694 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 59.3 tp -51.51 -53.56 36.26 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.605 1.162 . . . . 0.0 111.427 177.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 94.2 t80 -53.37 -53.1 55.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.655 1.182 . . . . 0.0 112.854 175.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.35 73.04 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.213 -0.929 . . . . 0.0 113.127 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -75.26 -36.21 61.28 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.98 0.912 . . . . 0.0 113.143 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.3 p -80.05 -26.14 39.85 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 119.843 1.202 . . . . 0.0 113.328 177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.79 -39.35 24.9 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.908 2.083 . . . . 0.0 113.968 178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -57.39 -54.13 50.27 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.446 1.898 . . . . 0.0 112.035 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 4.6 t -63.61 -42.65 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.964 2.105 . . . . 0.0 111.344 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.52 -16.55 62.9 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.762 1.625 . . . . 0.0 113.397 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 75.46 15.86 80.96 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 124.863 1.221 . . . . 0.0 114.995 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -79.51 82.72 5.6 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.379 1.472 . . . . 0.0 112.004 -175.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.485 1.289 0 C-N-CA 127.1 2.16 . . . . 0.0 112.027 176.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.457 0 CA-C-O 119.413 -0.659 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.0 -17.44 17.43 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.011 3.141 . . . . 0.0 114.834 -177.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -78.91 166.77 52.19 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.09 1.329 . . . . 0.0 114.437 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 58.5 p -78.62 -8.52 58.73 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.925 1.69 . . . . 0.0 115.542 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 61.45 159.48 0.05 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 128.698 2.799 . . . . 0.0 114.624 -172.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -67.59 -23.88 65.44 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.422 -1.424 . . . . 0.0 113.968 -177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -143.35 159.78 41.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.271 1.029 . . . . 0.0 113.422 -174.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 20.5 m -82.84 15.79 2.53 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.816 2.046 . . . . 0.0 115.394 -170.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.4 m -65.35 -2.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 N-CA-C 116.798 2.147 . . . . 0.0 116.798 -170.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -56.21 139.1 48.89 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.73 1.212 . . . . 0.0 112.725 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 16.0 m -69.79 -33.96 73.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.456 1.503 . . . . 0.0 113.555 -171.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.92 173.41 11.67 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.325 1.45 . . . . 0.0 113.799 -172.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.62 149.63 36.07 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.226 1.81 . . . . 0.0 110.67 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 21.9 m -77.98 57.54 1.78 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.473 1.909 . . . . 0.0 113.857 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 63.4 p -80.21 4.69 16.73 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 126.186 1.795 . . . . 0.0 115.709 -176.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -65.37 148.01 98.27 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.839 1.656 . . . . 0.0 113.259 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -79.97 -6.59 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.132 3.221 . . . . 0.0 113.996 175.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 65.9 mt -124.86 161.2 27.07 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.891 2.077 . . . . 0.0 110.855 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.3 t -137.74 177.11 8.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.471 1.508 . . . . 0.0 111.947 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -53.53 -37.64 63.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.848 1.659 . . . . 0.0 113.098 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -62.44 -31.35 72.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.135 0.974 . . . . 0.0 113.295 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.85 -42.77 66.53 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.188 -0.945 . . . . 0.0 111.563 178.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -69.24 -38.76 78.64 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.642 0.777 . . . . 0.0 112.042 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.9 t70 -61.71 -45.87 92.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.131 0.973 . . . . 0.0 111.778 172.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.37 -47.66 75.45 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.162 1.385 . . . . 0.0 111.809 171.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.5 t80 -51.9 -56.83 11.68 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.997 0.817 . . . . 0.0 111.879 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -69.33 -29.91 67.83 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.64 -47.78 77.24 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.778 -1.201 . . . . 0.0 111.974 172.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 45.9 mm -71.49 -32.47 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.718 1.207 . . . . 0.0 111.758 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -54.34 -45.04 72.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.187 1.395 . . . . 0.0 113.348 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.58 -27.01 62.33 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.564 1.546 . . . . 0.0 113.34 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -68.93 -20.45 64.22 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.185 1.794 . . . . 0.0 112.954 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -116.03 -17.32 10.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.938 2.095 . . . . 0.0 113.198 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 48.4 t0 -118.34 70.97 8.88 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.186 1.794 . . . . 0.0 110.931 172.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.43 -16.62 30.86 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.311 2.674 . . . . 0.0 112.668 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -71.63 -14.49 62.08 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.939 1.696 . . . . 0.0 112.874 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 49.94 22.63 0.91 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.898 2.079 . . . . 0.0 114.224 -166.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.3 t -76.12 -4.62 42.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.564 1.546 . . . . 0.0 113.93 -171.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 70.76 15.09 6.99 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.607 2.363 . . . . 0.0 113.861 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -130.08 147.04 51.78 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.671 1.589 . . . . 0.0 111.381 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 30.8 pt -132.49 159.69 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.454 1.502 . . . . 0.0 111.603 165.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.91 148.11 40.38 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.355 1.062 . . . . 0.0 112.053 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.32 -32.67 68.7 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.366 -0.834 . . . . 0.0 112.631 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.1 m -64.06 -14.71 56.43 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.87 2.068 . . . . 0.0 114.705 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.9 m -120.8 -13.55 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.827 1.251 . . . . 0.0 113.377 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.12 -38.56 73.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.793 1.237 . . . . 0.0 111.668 173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 64.9 p -64.64 -22.78 67.06 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 174.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.2 t70 -92.04 -32.13 15.31 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.074 0.852 . . . . 0.0 111.884 173.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.3 t80 -59.32 -48.96 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.272 . . . . 0.0 112.073 166.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.46 -29.9 51.2 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.004 1.322 . . . . 0.0 113.406 175.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -96.12 -3.86 43.79 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.784 1.633 . . . . 0.0 114.4 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.86 -20.08 21.83 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.685 -1.259 . . . . 0.0 112.984 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.0 mt -71.11 170.31 13.19 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.922 2.089 . . . . 0.0 111.876 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.5 t -102.42 164.8 11.47 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.53 0.732 . . . . 0.0 110.789 162.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.15 154.98 75.76 Favored Pre-proline 0 CA--C 1.553 1.089 0 O-C-N 121.195 -0.941 . . . . 0.0 111.176 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -71.19 -17.52 14.05 Favored 'Cis proline' 0 CA--C 1.544 0.984 0 N-CA-C 116.558 1.715 . . . . 0.0 116.558 -5.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.85 -27.35 65.75 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -171.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -53.04 132.37 37.76 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 127.489 2.316 . . . . 0.0 113.065 172.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -117.48 91.25 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.967 1.707 . . . . 0.0 107.568 163.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.11 145.68 54.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.625 0.77 . . . . 0.0 112.836 -176.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 44.3 mttt -65.76 153.24 91.43 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.609 1.164 . . . . 0.0 113.036 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.36 129.01 14.2 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 119.104 0.716 . . . . 0.0 111.29 -10.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.7 p30 -120.64 1.92 10.61 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -172.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -57.5 -41.15 80.22 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 120.049 1.295 . . . . 0.0 112.811 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.31 -45.35 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.09 0.956 . . . . 0.0 110.361 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 27.6 m -56.11 -43.89 78.57 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.578 1.551 . . . . 0.0 112.357 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.44 -32.88 62.79 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.381 1.472 . . . . 0.0 113.384 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 52.1 mt -62.09 -33.35 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.292 -0.88 . . . . 0.0 110.687 168.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.52 -3.57 53.5 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.25 166.17 23.83 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.674 1.579 . . . . 0.0 111.966 166.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 19.9 t0 -88.84 16.52 6.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.02 1.728 . . . . 0.0 114.085 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.62 129.95 81.31 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 126.401 1.88 . . . . 0.0 113.956 -169.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -78.19 179.92 6.05 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.961 3.107 . . . . 0.0 111.954 169.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 60.5 mtt -135.17 120.58 19.15 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.66 1.184 . . . . 0.0 109.829 162.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.7 m -73.31 -16.08 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 -167.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 21.8 t -144.9 -39.85 0.26 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.752 1.621 . . . . 0.0 112.269 176.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 163.91 -12.94 0.09 OUTLIER Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.296 1.427 . . . . 0.0 115.556 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -143.87 -7.74 0.74 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.197 1.925 . . . . 0.0 116.197 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -120.72 156.61 31.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.544 1.537 . . . . 0.0 112.778 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -138.94 136.5 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.893 1.677 . . . . 0.0 110.561 -167.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -76.77 138.43 39.9 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.963 2.105 . . . . 0.0 114.03 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.8 p -51.43 -50.6 59.4 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.642 1.577 . . . . 0.0 114.069 -176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -35.6 74.22 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.494 -0.754 . . . . 0.0 111.763 -176.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.34 -31.55 71.04 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.255 -0.903 . . . . 0.0 112.403 175.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.53 -49.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.35 1.06 . . . . 0.0 110.605 170.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 52.0 tp -54.38 -49.59 69.51 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.841 0.856 . . . . 0.0 111.588 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.01 -55.18 25.55 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.975 1.71 . . . . 0.0 112.421 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.64 77.82 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.429 0.692 . . . . 0.0 112.808 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -63.0 -53.67 50.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.914 0.886 . . . . 0.0 112.246 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 60.0 p -64.77 -32.16 73.72 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.128 -0.983 . . . . 0.0 113.494 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.57 -28.63 67.31 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.278 1.399 . . . . 0.0 113.791 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -71.08 -38.62 72.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.973 1.309 . . . . 0.0 112.174 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 18.4 t -68.56 -46.92 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.491 1.516 . . . . 0.0 111.094 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 52.8 mt -71.4 -17.09 62.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.889 2.076 . . . . 0.0 113.758 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 76.91 16.36 80.84 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 124.574 1.083 . . . . 0.0 114.819 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -80.12 -16.58 54.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.716 1.206 . . . . 0.0 114.076 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 124.678 1.191 . . . . 0.0 112.795 170.602 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.518 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.78 165.93 31.39 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.663 2.909 . . . . 0.0 113.037 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -68.82 -12.62 64.99 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.863 1.221 . . . . 0.0 115.2 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 74.7 m -65.13 -15.52 62.49 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -108.89 -25.75 10.6 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.306 1.442 . . . . 0.0 113.55 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -135.28 96.4 3.47 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.011 1.724 . . . . 0.0 110.576 -175.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 53.9 p90 -144.95 171.95 13.73 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.442 1.497 . . . . 0.0 113.258 -175.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 8.6 t -142.79 176.46 9.04 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.403 1.881 . . . . 0.0 110.44 169.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 t -127.85 85.51 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.617 1.567 . . . . 0.0 109.533 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -74.47 -14.87 60.89 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . 0.257 2.5 t 46.66 -174.04 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 129.885 3.274 . . . . 0.0 115.347 -175.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.09 148.43 47.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.442 1.497 . . . . 0.0 112.344 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -152.68 133.04 13.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.27 1.428 . . . . 0.0 111.173 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 46.5 m -70.36 156.58 39.12 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.74 1.216 . . . . 0.0 113.086 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 49.4 p -132.26 5.92 4.14 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.19 141.27 88.67 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.473 1.109 . . . . 0.0 112.246 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.12 -10.05 15.19 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 123.348 2.698 . . . . 0.0 114.427 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 55.9 mt -131.47 159.73 37.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.501 1.92 . . . . 0.0 111.531 -173.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 55.9 m -140.59 173.76 11.18 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.14 1.776 . . . . 0.0 111.246 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.77 -20.33 63.45 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.936 -1.103 . . . . 0.0 113.961 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.1 t70 -64.1 -33.5 75.92 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.867 1.267 . . . . 0.0 112.885 171.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -71.77 -41.14 68.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.022 0.929 . . . . 0.0 111.074 173.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -69.87 -33.75 72.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.685 0.794 . . . . 0.0 112.08 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.4 t70 -59.64 -45.97 90.41 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.053 0.941 . . . . 0.0 111.736 170.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -58.55 -43.2 89.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.058 0.943 . . . . 0.0 111.938 171.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.6 t80 -56.56 -56.67 18.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.772 0.714 . . . . 0.0 111.769 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -65.28 -31.39 72.52 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -60.45 -50.58 73.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.343 0.974 . . . . 0.0 111.11 172.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.0 mm -70.82 -33.86 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 123.976 0.91 . . . . 0.0 111.643 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.4 t-105 -52.4 -47.0 66.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.539 1.535 . . . . 0.0 113.595 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.76 -15.61 59.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.7 mttt -70.32 -20.37 63.01 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.821 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -116.46 -17.68 10.6 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.765 2.026 . . . . 0.0 113.079 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 49.5 t0 -116.58 77.06 7.77 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 126.403 1.881 . . . . 0.0 111.446 172.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.91 -17.45 28.77 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.235 2.623 . . . . 0.0 112.93 176.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -76.83 -14.08 59.94 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.428 1.491 . . . . 0.0 113.159 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.76 22.39 1.12 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.624 1.97 . . . . 0.0 114.324 -163.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.7 t -74.21 -10.01 59.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.447 1.499 . . . . 0.0 113.901 -171.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.77 26.3 11.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.022 2.129 . . . . 0.0 113.432 -176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.78 142.26 46.66 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.503 1.921 . . . . 0.0 110.528 170.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 33.6 pt -134.57 161.23 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 124.856 1.262 . . . . 0.0 111.627 169.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.77 150.61 36.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.174 0.99 . . . . 0.0 112.592 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.5 t80 -59.39 -32.27 70.0 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.208 -0.933 . . . . 0.0 112.919 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.5 p -67.36 -13.71 62.26 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.35 1.86 . . . . 0.0 114.991 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.9 m -117.86 -16.21 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.673 1.189 . . . . 0.0 113.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 4.9 tt -55.99 -41.14 74.37 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.262 1.425 . . . . 0.0 111.592 171.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.8 p -60.87 -38.14 84.58 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.7 t70 -76.4 -35.83 58.39 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.693 -0.63 . . . . 0.0 112.476 174.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -60.52 -46.38 90.36 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.457 1.503 . . . . 0.0 112.299 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.67 62.48 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.928 1.291 . . . . 0.0 113.068 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -94.23 -5.1 47.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.979 1.712 . . . . 0.0 114.425 175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.81 -18.66 25.84 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.479 -1.388 . . . . 0.0 113.353 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.08 165.66 24.6 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.467 1.907 . . . . 0.0 112.803 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 7.6 t -89.6 160.39 16.69 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.901 0.858 . . . . 0.0 110.868 164.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.24 151.82 80.62 Favored Pre-proline 0 CA--C 1.552 1.056 0 O-C-N 120.833 -1.167 . . . . 0.0 111.183 171.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -85.12 -7.11 52.07 Favored 'Cis proline' 0 CA--C 1.544 1.01 0 N-CA-C 114.844 1.055 . . . . 0.0 114.844 0.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 56.1 mt -69.09 -23.54 64.03 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.184 0.902 . . . . 0.0 113.315 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -50.94 131.89 26.85 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 128.458 2.703 . . . . 0.0 113.503 171.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -120.5 93.13 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.262 1.825 . . . . 0.0 107.596 163.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.76 145.85 51.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.849 0.86 . . . . 0.0 113.284 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.57 156.6 82.02 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.032 0.933 . . . . 0.0 112.934 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.23 132.79 10.05 Favored 'Cis proline' 0 CA--C 1.541 0.857 0 CA-C-N 118.321 0.436 . . . . 0.0 111.978 -17.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.8 p30 -125.54 -1.87 7.42 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.83 -34.71 68.01 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.78 -1.2 . . . . 0.0 113.675 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.8 mm -77.07 -39.14 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.307 1.043 . . . . 0.0 110.595 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 19.3 m -56.74 -45.59 81.89 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 111.947 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.82 -38.5 89.07 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.321 1.048 . . . . 0.0 112.866 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.88 -32.79 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.138 0.881 . . . . 0.0 111.574 173.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -77.92 -12.5 59.99 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.7 mtt -80.51 169.51 17.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.482 1.134 . . . . 0.0 112.461 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -83.52 8.64 13.44 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.309 1.844 . . . . 0.0 114.372 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.8 mt -49.91 118.8 9.22 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.502 1.921 . . . . 0.0 113.215 -173.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -76.28 178.83 7.01 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.007 3.138 . . . . 0.0 112.316 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 61.1 mtt -132.62 125.82 31.29 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.759 1.223 . . . . 0.0 110.189 162.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 12.3 m -77.27 -14.49 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -168.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 28.0 t -150.45 -47.39 0.12 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.959 1.704 . . . . 0.0 111.983 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 175.75 -14.37 0.04 OUTLIER Glycine 0 CA--C 1.54 1.606 0 N-CA-C 116.118 1.207 . . . . 0.0 116.118 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.47 -10.47 0.83 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.05 1.871 . . . . 0.0 116.05 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -115.06 157.33 23.66 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.806 1.642 . . . . 0.0 113.065 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.0 mp -140.02 136.11 38.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 126.847 2.059 . . . . 0.0 110.034 -170.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -74.04 137.7 43.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.942 1.697 . . . . 0.0 113.813 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 39.4 t -47.86 -55.69 9.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.141 2.176 . . . . 0.0 114.065 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.05 -37.31 85.53 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.784 -0.572 . . . . 0.0 112.148 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.47 -32.04 73.16 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.235 -0.915 . . . . 0.0 112.55 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 63.8 mt -66.43 -50.61 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.206 1.002 . . . . 0.0 110.328 170.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.4 tp -53.61 -47.27 70.38 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.028 0.531 . . . . 0.0 111.786 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.42 -53.83 53.71 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.988 1.315 . . . . 0.0 111.961 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.5 -41.35 72.93 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.224 -0.923 . . . . 0.0 113.074 176.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -70.16 -49.22 52.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.032 0.933 . . . . 0.0 111.953 178.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.1 p -65.0 -26.95 68.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -58.57 -31.71 68.26 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.966 1.257 . . . . 0.0 113.856 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -63.48 -44.39 94.56 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.565 1.146 . . . . 0.0 111.823 170.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 5.1 t -65.32 -41.91 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.169 1.388 . . . . 0.0 111.356 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 49.3 mt -69.38 -12.55 61.75 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.135 1.774 . . . . 0.0 113.608 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.54 12.92 84.06 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.524 1.535 . . . . 0.0 114.546 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -80.91 -14.34 58.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.004 1.321 . . . . 0.0 114.004 -177.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.251 1.147 0 C-N-CA 126.926 2.09 . . . . 0.0 112.273 -176.818 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.547 0 CA-C-O 119.882 -0.399 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.37 -18.09 18.24 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.904 3.07 . . . . 0.0 114.07 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.67 -16.1 8.7 Favored Glycine 0 CA--C 1.542 1.766 0 C-N-CA 125.873 1.701 . . . . 0.0 115.24 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 61.9 p -74.6 -14.71 60.81 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.901 1.68 . . . . 0.0 114.161 173.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -144.95 141.27 28.86 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.814 2.046 . . . . 0.0 110.771 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -147.57 147.1 29.72 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.42 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.35 -19.97 61.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.2 p -61.43 -13.25 18.85 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -170.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.0 m -60.09 -19.61 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.12 1.368 . . . . 0.0 113.598 168.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.06 -15.09 61.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.273 1.829 . . . . 0.0 114.346 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 86.8 m -95.32 -59.5 1.87 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.724 1.609 . . . . 0.0 110.208 174.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.45 156.17 38.95 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.997 1.319 . . . . 0.0 112.315 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.31 87.37 6.96 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.602 1.161 . . . . 0.0 111.311 174.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.4 p -67.0 -6.14 15.72 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.284 1.833 . . . . 0.0 115.402 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 13.1 p -75.33 65.18 1.61 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.814 2.446 . . . . 0.0 112.329 176.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -60.98 148.07 84.67 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 125.043 1.337 . . . . 0.0 113.117 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -84.77 -2.7 9.77 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.368 2.712 . . . . 0.0 115.517 -168.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -129.31 157.5 41.72 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.176 1.39 . . . . 0.0 112.218 -175.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 68.2 m -141.68 171.05 14.59 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.34 2.256 . . . . 0.0 111.709 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.13 -25.82 64.19 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.746 -1.221 . . . . 0.0 113.441 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.69 -30.62 70.04 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.987 1.315 . . . . 0.0 113.41 173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -71.48 -38.18 71.23 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.986 -1.071 . . . . 0.0 111.54 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -64.75 -46.89 80.28 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.71 1.204 . . . . 0.0 110.181 172.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 25.1 t70 -57.51 -45.68 84.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.82 0.848 . . . . 0.0 112.66 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 67.8 ttp -56.63 -49.67 74.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.85 1.26 . . . . 0.0 111.9 174.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -53.83 -55.53 25.76 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.663 0.785 . . . . 0.0 111.845 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -72.02 -19.87 61.78 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -67.13 -51.88 48.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.473 1.033 . . . . 0.0 111.475 167.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.7 -30.18 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.037 0.935 . . . . 0.0 112.214 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . 0.404 ' CZ2' ' HB3' ' A' 1850 ' ' CYS . 74.6 t-105 -51.52 -43.74 62.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.796 1.639 . . . . 0.0 114.258 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.93 -19.84 63.16 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.5 mttm -69.19 -22.01 63.93 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.162 1.385 . . . . 0.0 113.042 175.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -114.55 -21.47 10.27 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.719 2.008 . . . . 0.0 113.315 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.8 t0 -124.05 71.97 54.08 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.42 1.888 . . . . 0.0 111.156 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -71.71 -20.08 26.92 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.391 2.727 . . . . 0.0 112.939 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -78.25 -9.35 59.18 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.418 1.487 . . . . 0.0 112.917 173.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.37 22.65 6.55 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.402 2.281 . . . . 0.0 115.223 -178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 81.1 p -70.29 -9.78 57.01 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 76.16 16.1 2.27 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.175 2.59 . . . . 0.0 114.303 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -129.73 154.25 47.37 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.767 1.227 . . . . 0.0 112.157 174.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.0 pt -137.27 161.8 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.922 1.689 . . . . 0.0 110.958 165.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.46 151.96 34.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.702 0.801 . . . . 0.0 112.197 172.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.47 -30.76 68.76 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.975 -1.078 . . . . 0.0 113.096 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -63.17 -18.7 63.77 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.368 1.867 . . . . 0.0 114.681 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.56 -11.08 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.718 1.207 . . . . 0.0 114.095 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.84 -43.97 81.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.349 1.06 . . . . 0.0 110.808 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 3.7 m -58.42 -32.73 68.94 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.496 1.118 . . . . 0.0 113.963 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.07 -37.0 27.05 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.302 -0.874 . . . . 0.0 112.503 176.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.0 t80 -59.65 -44.0 93.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.012 1.325 . . . . 0.0 112.687 169.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.5 -28.69 46.83 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.166 1.386 . . . . 0.0 113.572 173.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.5 t70 -99.4 -2.36 36.39 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.119 1.768 . . . . 0.0 113.855 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.83 -21.5 22.55 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.442 -1.411 . . . . 0.0 113.057 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.08 171.27 11.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.706 2.002 . . . . 0.0 112.873 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -104.0 165.73 10.86 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.786 0.803 . . . . 0.0 110.799 162.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.24 151.43 81.74 Favored Pre-proline 0 CA--C 1.552 1.027 0 O-C-N 121.291 -0.881 . . . . 0.0 111.322 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -85.51 -9.74 46.11 Favored 'Cis proline' 0 CA--C 1.546 1.094 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 2.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.2 -25.01 62.33 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.436 1.017 . . . . 0.0 113.344 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -51.57 132.02 29.97 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.566 2.346 . . . . 0.0 112.747 172.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.75 94.02 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.982 1.313 . . . . 0.0 108.296 165.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.35 142.97 56.53 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.343 0.657 . . . . 0.0 112.549 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.8 mttt -65.23 156.15 82.22 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.434 1.094 . . . . 0.0 112.941 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.45 133.06 10.74 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 118.629 0.546 . . . . 0.0 112.195 -17.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 56.8 p30 -128.2 -4.14 5.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -59.05 -36.32 74.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.612 1.096 . . . . 0.0 113.44 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 70.1 mt -64.33 -37.44 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 110.513 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 7.8 t -61.76 -48.4 80.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.95 -0.548 . . . . 0.0 111.232 172.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 26.3 mt -57.57 -41.81 81.82 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.959 0.8 . . . . 0.0 112.478 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 67.5 mt -60.25 -36.51 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.271 1.428 . . . . 0.0 112.091 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -79.72 -17.8 52.72 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 175.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.1 mtt -74.05 168.62 19.16 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.944 1.247 . . . . 0.0 111.982 172.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.4 t70 -90.88 14.07 14.72 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.409 1.884 . . . . 0.0 113.771 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.8 mt -49.37 116.27 5.63 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 126.631 1.972 . . . . 0.0 113.021 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -77.61 179.08 6.86 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 124.03 3.153 . . . . 0.0 111.745 175.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.1 mtt -137.4 128.49 27.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.606 1.162 . . . . 0.0 110.574 167.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.0 m -76.9 -25.93 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.496 1.118 . . . . 0.0 113.925 -173.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.4 p -135.87 7.37 3.21 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.202 1.801 . . . . 0.0 114.328 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.98 -0.16 64.21 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.955 1.74 . . . . 0.0 114.323 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -149.09 -12.79 0.31 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 116.006 1.854 . . . . 0.0 116.006 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -125.72 155.88 40.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.93 1.692 . . . . 0.0 112.056 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.9 mp -139.29 131.27 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.736 1.614 . . . . 0.0 110.414 -167.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -72.72 142.91 48.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.013 1.725 . . . . 0.0 113.116 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . 0.404 ' HB3' ' CZ2' ' A' 1798 ' ' TRP . 30.1 p -52.05 -51.82 55.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.273 1.429 . . . . 0.0 114.227 -176.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -33.86 75.98 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.542 -0.724 . . . . 0.0 111.714 -176.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.7 -27.97 65.43 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.119 -0.988 . . . . 0.0 112.905 177.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -71.87 -49.72 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.061 0.944 . . . . 0.0 110.397 168.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 70.4 tp -55.14 -42.4 73.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.536 1.135 . . . . 0.0 112.832 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 76.7 t80 -54.34 -51.48 64.57 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.326 1.85 . . . . 0.0 111.928 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.62 -50.96 71.44 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.588 -0.695 . . . . 0.0 112.223 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.14 -32.74 74.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.358 1.063 . . . . 0.0 113.328 -175.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 36.1 p -76.73 -41.92 43.22 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.998 -1.064 . . . . 0.0 112.461 172.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -60.21 -31.49 70.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.501 1.046 . . . . 0.0 113.723 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -54.21 -36.91 63.97 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.149 1.38 . . . . 0.0 113.116 168.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 10.4 t -82.66 -47.03 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.858 1.663 . . . . 0.0 111.114 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.73 -34.92 78.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.957 1.303 . . . . 0.0 113.146 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 79.8 -6.24 59.35 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 126.499 2.0 . . . . 0.0 116.541 171.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.27 22.72 6.46 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 126.75 2.02 . . . . 0.0 114.451 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.921 2.088 . . . . 0.0 113.951 -178.999 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-O 119.089 -0.839 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.14 167.31 27.49 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.739 2.96 . . . . 0.0 113.282 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -155.62 23.79 0.56 Allowed Glycine 0 N--CA 1.475 1.279 0 C-N-CA 125.566 1.555 . . . . 0.0 114.451 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 15.1 m -62.76 -12.35 23.57 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -164.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.09 -39.77 60.24 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.875 1.67 . . . . 0.0 112.725 166.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 47.2 t30 -82.62 -14.65 54.38 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.223 1.409 . . . . 0.0 114.042 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -84.71 168.09 15.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.663 1.185 . . . . 0.0 112.849 -173.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 15.8 m -70.02 3.1 2.92 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.598 1.959 . . . . 0.0 115.703 -176.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.7 m -66.32 -12.34 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 126.187 1.795 . . . . 0.0 115.321 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -68.24 160.84 28.47 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.207 1.403 . . . . 0.0 113.316 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 10.8 t -74.24 166.02 24.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.827 0.851 . . . . 0.0 112.089 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -132.96 1.62 3.58 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.224 1.81 . . . . 0.0 113.717 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.92 153.05 46.84 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.758 1.223 . . . . 0.0 114.004 -175.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 74.1 m -147.23 88.57 1.73 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.328 2.251 . . . . 0.0 108.935 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.7 m -134.33 149.87 50.9 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.62 1.168 . . . . 0.0 112.084 -163.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -137.22 156.84 75.21 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.63 1.972 . . . . 0.0 111.044 174.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.66 -7.06 12.59 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.287 2.658 . . . . 0.0 115.708 -167.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.7 mt -129.59 166.7 19.21 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 112.067 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 23.2 t -138.3 167.54 21.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.135 1.774 . . . . 0.0 111.366 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.32 -27.85 64.5 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.653 1.181 . . . . 0.0 112.774 173.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.24 -32.24 69.8 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.246 1.418 . . . . 0.0 113.402 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -69.97 -40.14 75.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.916 0.887 . . . . 0.0 112.0 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -64.97 -44.84 88.03 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.37 1.068 . . . . 0.0 111.097 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -58.75 -47.56 84.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.737 0.815 . . . . 0.0 112.181 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.7 tmm? -57.35 -46.5 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.649 1.18 . . . . 0.0 112.349 172.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 43.9 t80 -54.38 -54.52 39.49 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.563 0.619 . . . . 0.0 112.239 176.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -68.27 -29.88 68.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.58 -32.15 73.67 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.549 1.068 . . . . 0.0 112.809 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.5 mm -86.12 -33.95 7.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 124.274 1.029 . . . . 0.0 111.915 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -51.35 -45.54 62.39 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.44 1.496 . . . . 0.0 113.827 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -60.92 -20.86 62.73 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.693 1.197 . . . . 0.0 113.39 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 45.1 mttp -73.96 -18.15 60.92 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.414 1.486 . . . . 0.0 112.903 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -116.28 -23.21 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.11 2.164 . . . . 0.0 113.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.2 t0 -127.19 69.72 74.38 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.435 1.894 . . . . 0.0 110.762 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.85 -19.1 36.12 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.62 2.88 . . . . 0.0 112.363 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -76.14 -8.53 57.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.062 1.745 . . . . 0.0 113.292 172.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.58 26.71 9.44 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.844 2.058 . . . . 0.0 114.632 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.4 p -63.07 -18.69 63.65 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.749 1.62 . . . . 0.0 114.439 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 71.82 19.56 4.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.44 2.296 . . . . 0.0 113.303 -171.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -137.04 146.28 45.05 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.051 0.841 . . . . 0.0 112.641 174.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.8 pt -133.3 159.35 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.946 1.298 . . . . 0.0 111.392 168.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.46 148.04 39.37 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.274 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.32 -28.69 67.04 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.4 -0.812 . . . . 0.0 112.054 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 22.8 m -65.66 -15.88 63.2 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.416 1.886 . . . . 0.0 115.135 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 28.8 m -121.0 -11.83 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 125.053 1.341 . . . . 0.0 113.673 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 58.2 tp -53.92 -35.83 62.11 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.516 1.526 . . . . 0.0 112.57 173.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 23.7 p -61.44 -41.17 96.78 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.195 1.398 . . . . 0.0 113.335 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 18.7 t70 -79.1 -37.76 37.91 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.316 -0.865 . . . . 0.0 112.194 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.36 -47.88 80.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.355 0.525 . . . . 0.0 112.057 170.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.48 -21.43 16.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.251 1.42 . . . . 0.0 114.271 177.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 25.5 t70 -105.98 -12.95 15.63 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.852 1.206 . . . . 0.0 114.151 177.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -79.48 -19.25 50.2 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.374 1.07 . . . . 0.0 112.742 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 6.0 mt -69.34 167.99 15.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.9 2.08 . . . . 0.0 111.747 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.5 m -83.43 156.0 23.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.546 0.739 . . . . 0.0 111.098 165.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -65.89 149.62 97.35 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 121.349 -0.845 . . . . 0.0 110.223 163.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.96 -7.98 45.61 Favored 'Cis proline' 0 CA--C 1.543 0.968 0 N-CA-C 115.325 1.24 . . . . 0.0 115.325 3.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 20.0 mt -65.27 -39.52 92.7 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.319 1.418 . . . . 0.0 113.402 -176.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.41 155.4 32.65 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.689 0.677 . . . . 0.0 112.737 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.7 mp -120.68 104.33 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 127.162 2.185 . . . . 0.0 107.864 178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -52.9 108.77 0.35 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.555 1.542 . . . . 0.0 113.363 -169.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.2 141.07 94.23 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.189 1.396 . . . . 0.0 111.982 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 128.68 10.93 Favored 'Cis proline' 0 C--N 1.355 0.896 0 CA-C-N 120.777 1.313 . . . . 0.0 113.408 1.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.2 p30 -128.69 2.45 5.48 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.854 1.662 . . . . 0.0 114.295 -170.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.52 -36.1 66.36 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.63 1.104 . . . . 0.0 113.321 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 87.7 mt -70.1 -42.47 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.292 1.437 . . . . 0.0 110.547 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 8.6 m -58.41 -44.39 89.01 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.082 1.353 . . . . 0.0 112.656 176.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 90.9 mt -57.94 -47.94 81.41 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.017 0.927 . . . . 0.0 111.627 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 82.7 mt -63.07 -30.88 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.441 1.096 . . . . 0.0 111.902 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -80.83 -20.1 43.16 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 71.6 mtm -78.61 167.19 21.62 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.395 1.078 . . . . 0.0 111.935 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -78.09 6.17 8.51 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.08 1.752 . . . . 0.0 114.19 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 34.2 mt -48.99 115.22 4.39 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.784 2.034 . . . . 0.0 113.491 -174.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.17 -173.86 2.03 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.563 3.509 . . . . 0.0 111.864 175.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.53 155.01 41.28 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.284 1.034 . . . . 0.0 110.167 153.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -94.18 -21.33 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.717 1.207 . . . . 0.0 113.238 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -128.13 -7.24 5.41 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.299 1.84 . . . . 0.0 114.268 -175.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.1 -9.45 76.41 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 126.183 1.849 . . . . 0.0 113.559 -165.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -135.63 -27.67 1.15 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.261 1.531 . . . . 0.0 114.889 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -112.34 161.41 16.69 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.846 1.259 . . . . 0.0 112.643 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -135.3 141.62 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.316 1.846 . . . . 0.0 109.608 -178.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -74.52 140.57 44.6 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.444 1.498 . . . . 0.0 113.57 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -45.82 -56.92 4.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.592 2.357 . . . . 0.0 113.951 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -30.65 69.8 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.34 -37.84 65.96 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.043 -1.035 . . . . 0.0 111.933 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -60.31 -51.65 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.007 0.923 . . . . 0.0 110.047 168.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.4 tp -51.67 -53.3 40.44 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.036 0.935 . . . . 0.0 111.768 175.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.5 t80 -55.13 -50.43 69.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.661 1.184 . . . . 0.0 112.746 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.06 81.3 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.944 -1.097 . . . . 0.0 112.245 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -70.65 -36.48 73.42 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.523 -0.736 . . . . 0.0 112.961 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 50.6 p -78.91 -32.84 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.974 1.261 . . . . 0.0 113.199 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 57.9 tttp -50.49 -40.47 51.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.412 1.885 . . . . 0.0 112.623 176.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.8 mtp-105 -48.86 -59.67 3.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.072 1.749 . . . . 0.0 112.109 168.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.7 t -65.16 -35.8 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.568 1.947 . . . . 0.0 111.788 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.36 -9.11 55.32 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.032 1.733 . . . . 0.0 114.71 174.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 117.79 11.66 8.36 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 125.452 1.501 . . . . 0.0 116.134 172.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.97 -4.11 0.85 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 128.617 2.767 . . . . 0.0 115.59 -176.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.334 2.254 . . . . 0.0 113.43 175.501 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.81 92.06 0.52 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.835 3.69 . . . . 0.0 111.876 -178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -144.04 11.95 2.1 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.709 1.623 . . . . 0.0 114.974 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.4 m -58.95 134.78 57.26 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 113.016 -175.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.35 4.58 2.67 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.285 1.434 . . . . 0.0 113.642 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -62.2 -18.91 62.41 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.453 1.501 . . . . 0.0 114.184 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 42.1 p90 -66.58 -15.64 63.58 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.225 1.41 . . . . 0.0 114.447 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 71.3 m -74.42 81.24 1.91 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.5 1.52 . . . . 0.0 112.516 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 58.4 t -65.79 113.97 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.591 1.556 . . . . 0.0 110.747 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -72.89 -175.7 1.82 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.112 1.365 . . . . 0.0 113.809 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 23.1 p -131.94 160.7 35.02 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.398 1.879 . . . . 0.0 112.528 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -78.1 145.78 35.57 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.014 1.325 . . . . 0.0 111.654 175.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -95.26 -7.22 39.48 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -176.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 25.6 m -74.25 -3.76 31.96 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.146 1.778 . . . . 0.0 114.417 -176.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 64.5 p -73.61 25.6 0.07 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 128.732 2.813 . . . . 0.0 115.094 -174.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -58.43 147.51 68.31 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.499 1.52 . . . . 0.0 113.401 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -79.45 -9.37 14.92 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.63 2.887 . . . . 0.0 114.576 -174.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 74.5 mt -133.52 156.07 48.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.938 2.095 . . . . 0.0 111.018 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -142.15 175.55 9.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.095 1.758 . . . . 0.0 111.371 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.3 -33.29 65.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.686 1.194 . . . . 0.0 112.949 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.54 -34.14 73.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.088 1.355 . . . . 0.0 113.143 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -70.08 -38.92 75.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.865 0.866 . . . . 0.0 112.134 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -74.26 -37.65 63.68 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.784 0.833 . . . . 0.0 111.597 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.31 -46.16 89.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.185 0.994 . . . . 0.0 111.477 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.8 ttp -54.78 -48.1 73.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.105 1.362 . . . . 0.0 111.694 171.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.8 t80 -52.31 -58.66 5.98 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.527 0.731 . . . . 0.0 111.559 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.08 -27.73 66.75 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.21 -54.45 33.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.433 1.015 . . . . 0.0 111.823 170.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 41.5 mm -66.15 -33.98 67.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.203 1.001 . . . . 0.0 111.625 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.5 t-105 -51.13 -42.72 60.9 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.493 1.517 . . . . 0.0 113.926 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -57.63 -27.4 62.76 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.967 1.307 . . . . 0.0 113.487 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -68.89 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.988 1.315 . . . . 0.0 113.505 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -112.99 -16.21 12.71 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.201 1.8 . . . . 0.0 113.849 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.3 t0 -122.91 73.9 46.5 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.09 1.756 . . . . 0.0 111.508 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -71.49 -18.75 29.22 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.436 2.758 . . . . 0.0 113.128 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -76.86 -13.54 59.99 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.377 1.471 . . . . 0.0 113.368 173.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.85 25.19 3.73 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.646 1.978 . . . . 0.0 113.332 -167.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.4 t -71.49 -11.98 61.15 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.586 1.554 . . . . 0.0 113.813 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 73.2 15.19 4.45 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.921 2.489 . . . . 0.0 113.686 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -129.83 152.98 48.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.257 1.823 . . . . 0.0 111.392 175.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 45.7 pt -136.34 167.68 23.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 125.436 1.494 . . . . 0.0 110.821 165.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -89.28 149.39 23.08 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.629 1.172 . . . . 0.0 111.799 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.16 -26.95 68.62 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.897 -1.127 . . . . 0.0 112.713 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 63.7 p -68.05 -15.18 63.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.13 1.772 . . . . 0.0 114.917 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.3 m -118.46 -12.08 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.786 1.234 . . . . 0.0 113.369 173.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 56.6 tp -54.17 -40.56 67.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.026 1.33 . . . . 0.0 112.269 170.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 27.3 p -65.32 -30.07 70.89 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -79.45 -39.45 32.23 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.154 -0.966 . . . . 0.0 111.881 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 52.9 t80 -58.58 -49.79 76.16 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.972 1.309 . . . . 0.0 112.257 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.74 -32.24 59.53 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.001 1.321 . . . . 0.0 113.623 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -86.11 -17.85 33.93 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.273 1.429 . . . . 0.0 113.869 177.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -87.77 -19.62 27.28 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.229 1.012 . . . . 0.0 113.63 -172.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 5.4 mt -73.34 174.07 8.63 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.06 1.744 . . . . 0.0 111.024 174.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.6 t -105.12 166.41 10.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.139 0.975 . . . . 0.0 111.788 169.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.26 153.2 92.94 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.412 1.085 . . . . 0.0 111.286 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -81.61 -11.2 41.16 Favored 'Cis proline' 0 CA--C 1.544 0.977 0 N-CA-C 115.283 1.224 . . . . 0.0 115.283 0.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 71.5 mt -67.42 -38.52 84.73 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.72 159.73 24.42 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.49 99.33 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 C-N-CA 125.914 1.686 . . . . 0.0 108.033 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 140.99 57.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.8 148.99 74.42 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.006 0.923 . . . . 0.0 112.507 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.98 133.41 25.89 Favored 'Cis proline' 0 CA--C 1.542 0.901 0 CA-C-N 118.915 0.648 . . . . 0.0 111.277 -9.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 39.5 p30 -127.69 -2.47 6.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.472 1.509 . . . . 0.0 114.643 -174.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -55.98 -42.57 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.594 -1.316 . . . . 0.0 112.451 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 69.3 mt -67.95 -42.09 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.136 0.974 . . . . 0.0 110.652 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -56.3 -48.7 76.13 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.514 1.525 . . . . 0.0 111.751 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.36 -47.14 87.22 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.732 1.613 . . . . 0.0 112.205 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.22 -33.1 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.93 -1.106 . . . . 0.0 112.411 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -77.6 -9.88 59.19 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 61.4 mtt -77.71 172.57 13.21 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.279 1.4 . . . . 0.0 112.469 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 21.9 t0 -78.49 8.7 4.79 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 126.436 1.894 . . . . 0.0 113.879 172.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 40.8 mt -52.17 120.13 16.34 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.399 1.88 . . . . 0.0 113.252 -175.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -79.24 -175.01 2.52 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.749 2.966 . . . . 0.0 111.799 172.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.7 mtt -134.6 157.46 46.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.881 1.272 . . . . 0.0 110.339 158.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 20.4 m -108.49 -15.66 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.518 1.127 . . . . 0.0 113.871 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 93.3 p -134.83 -7.23 2.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.176 1.79 . . . . 0.0 114.639 -176.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.54 -2.39 86.23 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.09 1.329 . . . . 0.0 114.494 -163.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -142.19 -15.56 0.77 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -121.06 161.55 21.51 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.3 1.44 . . . . 0.0 112.788 -173.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -140.95 142.74 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.278 1.831 . . . . 0.0 110.751 -176.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -77.57 144.18 37.76 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.286 1.834 . . . . 0.0 113.337 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.5 p -51.82 -52.52 48.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.277 1.431 . . . . 0.0 114.275 -177.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.8 tpt -68.35 -30.2 69.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.262 -0.899 . . . . 0.0 112.509 -176.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -74.21 -31.7 62.74 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.423 -0.798 . . . . 0.0 112.061 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 57.3 mt -65.51 -49.48 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 124.166 0.986 . . . . 0.0 110.012 167.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.68 -48.24 72.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.471 1.108 . . . . 0.0 111.704 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.44 -47.41 76.04 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.407 1.883 . . . . 0.0 112.515 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.04 87.84 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -66.81 -47.06 73.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.139 0.976 . . . . 0.0 112.376 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 32.3 p -62.3 -38.81 90.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.117 0.967 . . . . 0.0 112.993 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.8 mttt -52.62 -43.06 65.14 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.622 1.101 . . . . 0.0 113.148 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -62.2 -41.4 98.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.753 0.821 . . . . 0.0 112.828 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 42.7 t -67.95 -42.75 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.358 1.063 . . . . 0.0 111.513 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.46 -9.13 52.34 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.884 1.673 . . . . 0.0 114.234 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 102.6 7.36 45.43 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.515 1.531 . . . . 0.0 115.393 171.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 62.9 -1.89 0.44 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.036 2.534 . . . . 0.0 116.484 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.652 1.981 . . . . 0.0 112.045 -176.963 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -56.75 -27.11 69.63 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.756 3.638 . . . . 0.0 115.959 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -177.56 -177.94 46.78 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 125.797 1.665 . . . . 0.0 113.09 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.4 t -144.6 170.34 16.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.514 1.526 . . . . 0.0 111.923 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.07 166.61 22.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.567 1.547 . . . . 0.0 113.507 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 1.4 t30 -78.06 76.07 4.58 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.671 1.189 . . . . 0.0 110.272 169.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.8 t80 -69.18 97.17 0.89 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.462 1.505 . . . . 0.0 112.236 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 55.4 m -142.56 147.61 36.19 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.641 1.576 . . . . 0.0 111.335 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 47.6 t -74.95 -34.97 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.195 0.998 . . . . 0.0 111.914 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.03 134.65 55.4 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.352 1.461 . . . . 0.0 111.597 173.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.8 t -150.77 159.67 44.38 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.783 1.233 . . . . 0.0 111.772 -177.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -61.42 -22.41 64.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.203 1.401 . . . . 0.0 113.137 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -72.51 -11.39 60.64 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.659 1.184 . . . . 0.0 114.179 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 38.4 m -135.24 -15.78 1.92 Allowed 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -169.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 6.3 t -155.48 169.83 23.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.747 1.219 . . . . 0.0 112.699 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.44 154.38 69.45 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 127.664 2.386 . . . . 0.0 110.768 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.27 -6.47 13.83 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.842 2.361 . . . . 0.0 114.87 -172.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 97.9 mt -132.17 156.72 45.92 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 111.917 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 49.9 m -140.95 174.17 10.78 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.111 2.164 . . . . 0.0 112.054 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.11 -32.88 66.76 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.768 -1.208 . . . . 0.0 113.262 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.75 -31.14 69.37 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.337 1.455 . . . . 0.0 113.818 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.315 -0.865 . . . . 0.0 112.176 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -68.14 -42.39 80.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.543 -0.723 . . . . 0.0 111.886 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.96 -48.14 79.05 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.766 0.826 . . . . 0.0 111.793 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 15.1 tmm? -56.26 -49.46 74.13 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.336 1.455 . . . . 0.0 111.769 172.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.1 t80 -54.16 -57.09 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.322 0.649 . . . . 0.0 112.013 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -66.82 -27.53 67.63 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -66.56 -48.33 69.98 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.715 -1.241 . . . . 0.0 112.061 170.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.8 mm -73.69 -25.16 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 O-C-N 120.998 -1.064 . . . . 0.0 111.894 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -56.71 -49.03 76.37 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.145 1.378 . . . . 0.0 113.415 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.94 -17.43 63.24 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -71.15 -23.62 62.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.587 1.555 . . . . 0.0 112.577 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.35 -21.06 12.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.582 1.953 . . . . 0.0 113.211 177.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 38.0 t0 -118.43 71.85 9.69 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.444 1.897 . . . . 0.0 111.295 172.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.12 -19.99 29.09 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 123.078 2.519 . . . . 0.0 112.944 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.02 -10.39 59.58 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.367 1.467 . . . . 0.0 113.185 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 18.47 2.94 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 127.721 2.409 . . . . 0.0 115.511 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 76.2 p -69.02 -8.37 44.34 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 73.01 25.03 2.42 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 127.609 2.364 . . . . 0.0 113.534 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -131.94 151.4 51.74 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.832 1.253 . . . . 0.0 112.291 168.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.0 pt -135.01 160.68 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.127 1.371 . . . . 0.0 111.013 165.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -78.26 150.86 33.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.312 1.045 . . . . 0.0 112.097 175.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.5 -29.05 67.59 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.032 -1.043 . . . . 0.0 112.116 173.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 18.9 m -62.33 -16.9 57.09 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.956 2.102 . . . . 0.0 114.935 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -122.52 -12.81 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 125.291 1.436 . . . . 0.0 113.695 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 48.0 tp -51.97 -41.55 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.135 1.374 . . . . 0.0 112.446 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 31.6 p -65.95 -35.64 81.17 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.52 -39.5 52.79 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.707 -0.621 . . . . 0.0 111.838 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 38.7 t80 -57.71 -52.13 66.7 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.75 -31.09 47.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.793 1.637 . . . . 0.0 113.847 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.9 t70 -85.24 -27.3 26.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.634 1.174 . . . . 0.0 113.902 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -82.54 -17.17 45.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.142 1.377 . . . . 0.0 113.917 -169.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.5 170.35 9.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.521 1.528 . . . . 0.0 111.133 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 68.0 m -81.06 151.81 28.18 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.249 -0.907 . . . . 0.0 111.781 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -65.14 150.87 94.88 Favored Pre-proline 0 CA--C 1.55 0.947 0 O-C-N 121.497 -0.752 . . . . 0.0 109.991 164.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -83.7 -11.47 42.38 Favored 'Cis proline' 0 CA--C 1.544 1.006 0 N-CA-C 115.811 1.427 . . . . 0.0 115.811 4.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.92 -45.06 93.81 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.33 1.423 . . . . 0.0 113.358 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.37 152.42 29.62 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.472 0.709 . . . . 0.0 112.645 -175.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.85 99.35 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 126.259 1.824 . . . . 0.0 107.526 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -59.13 135.63 57.7 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.39 1.076 . . . . 0.0 112.106 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -59.05 149.46 66.6 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 123.985 0.914 . . . . 0.0 112.998 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -70.78 134.28 30.81 Favored 'Cis proline' 0 C--N 1.356 0.959 0 CA-C-N 118.9 0.643 . . . . 0.0 111.403 -11.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.1 p30 -124.09 -0.82 8.32 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -170.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -55.48 -43.46 75.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.009 1.277 . . . . 0.0 113.357 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 75.3 mt -65.28 -47.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.267 1.027 . . . . 0.0 110.35 174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 41.7 m -57.68 -33.81 68.74 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.074 1.75 . . . . 0.0 113.48 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.95 -43.0 25.54 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.837 2.055 . . . . 0.0 112.513 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.69 -31.32 43.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.576 1.151 . . . . 0.0 111.654 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -72.54 -9.26 58.36 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 174.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.5 mtt -78.01 167.03 22.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.199 1.363 . . . . 0.0 112.376 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -89.07 11.44 18.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.196 1.798 . . . . 0.0 113.398 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.6 mt -57.43 141.37 78.34 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.996 1.318 . . . . 0.0 113.977 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.9 173.16 14.92 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.639 2.893 . . . . 0.0 112.65 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -128.29 90.22 3.04 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.67 1.588 . . . . 0.0 108.848 162.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 14.2 m -65.06 -23.93 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -164.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 52.0 p -137.91 9.12 2.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.767 2.027 . . . . 0.0 113.747 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 107.03 -17.17 38.38 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.463 1.982 . . . . 0.0 115.028 177.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.71 -8.06 1.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -122.1 155.78 34.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.301 1.44 . . . . 0.0 113.755 -171.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 1.7 mp -131.12 136.2 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.493 1.917 . . . . 0.0 110.174 -175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -71.43 138.01 48.73 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.387 1.475 . . . . 0.0 113.721 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 53.5 t -43.7 -59.26 2.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.506 2.723 . . . . 0.0 114.041 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -65.49 -37.73 87.68 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -175.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.42 -36.64 84.83 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.096 -1.002 . . . . 0.0 112.223 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.39 -52.56 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.251 1.021 . . . . 0.0 110.696 171.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.7 tp -52.3 -48.68 65.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.227 1.011 . . . . 0.0 112.027 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 9.4 t80 -58.54 -50.68 72.89 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.314 1.446 . . . . 0.0 111.59 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -59.6 -40.67 88.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -66.93 -53.2 34.22 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.551 0.74 . . . . 0.0 111.036 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.2 p -66.44 -30.67 71.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.9 mttm -51.61 -47.41 63.64 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.32 1.418 . . . . 0.0 112.924 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.26 -34.25 77.69 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.885 1.274 . . . . 0.0 112.697 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.5 t -70.66 -49.12 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.827 1.251 . . . . 0.0 111.082 174.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 56.5 mt -65.9 -24.47 66.85 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.922 1.689 . . . . 0.0 113.634 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 71.88 24.93 75.92 Favored Glycine 0 CA--C 1.539 1.547 0 C-N-CA 124.211 0.91 . . . . 0.0 113.607 -172.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -59.02 129.32 41.61 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.407 1.483 . . . . 0.0 111.722 -176.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.429 1.892 . . . . 0.0 112.505 -173.578 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.41 168.12 1.63 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.663 3.575 . . . . 0.0 115.471 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -77.19 96.7 1.24 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.333 1.444 . . . . 0.0 112.351 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 50.7 m -63.34 -16.68 61.12 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -173.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -138.61 114.44 9.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 111.521 176.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 31.0 t30 -68.37 -37.02 80.03 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.228 1.411 . . . . 0.0 113.754 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -70.72 154.51 41.78 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.119 1.155 . . . . 0.0 114.119 -164.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 89.7 p -137.45 -3.29 1.92 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . 0.262 26.1 m 45.58 28.13 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 128.305 2.642 . . . . 0.0 115.527 -175.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.76 172.46 3.5 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.465 1.506 . . . . 0.0 114.063 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.6 t -58.32 -22.49 53.28 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.688 1.595 . . . . 0.0 114.52 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -60.2 -18.96 51.95 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.028 1.331 . . . . 0.0 113.378 173.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.33 -17.68 62.43 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.152 1.381 . . . . 0.0 113.778 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 49.8 m -124.9 -6.49 7.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.553 1.541 . . . . 0.0 115.103 -169.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 5.3 t -74.68 167.2 22.26 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.426 1.09 . . . . 0.0 112.511 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -150.95 141.63 14.77 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.589 1.555 . . . . 0.0 112.128 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.68 -8.74 8.15 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.403 2.736 . . . . 0.0 114.906 -171.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 64.5 mt -130.0 159.72 35.85 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.339 1.856 . . . . 0.0 111.37 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.5 t -143.14 174.56 10.59 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.043 1.737 . . . . 0.0 111.992 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.49 -34.64 62.0 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.718 1.607 . . . . 0.0 112.24 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.6 t70 -60.72 -33.76 73.37 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.666 1.587 . . . . 0.0 113.47 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -69.22 -44.42 72.09 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.495 -0.753 . . . . 0.0 111.88 176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -66.69 -42.51 86.36 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.789 0.836 . . . . 0.0 111.857 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.9 -46.97 81.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.613 0.765 . . . . 0.0 111.879 172.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.6 tmm? -59.03 -45.42 90.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.801 1.241 . . . . 0.0 112.404 173.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.91 -53.59 50.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.746 0.703 . . . . 0.0 111.632 174.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.1 -37.18 85.13 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.72 -32.44 73.93 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.079 0.952 . . . . 0.0 112.838 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.6 mm -83.79 -36.27 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 124.373 1.069 . . . . 0.0 111.562 173.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -52.96 -47.17 68.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.448 1.499 . . . . 0.0 113.414 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.85 -15.58 43.4 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -73.43 -21.44 60.47 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.579 1.152 . . . . 0.0 112.882 173.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -114.4 -22.54 9.82 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.596 1.958 . . . . 0.0 113.268 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 24.9 t0 -124.94 67.58 53.2 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.341 1.856 . . . . 0.0 110.515 170.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -69.46 -19.64 37.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.989 2.459 . . . . 0.0 112.683 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.64 -8.4 56.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.331 1.853 . . . . 0.0 113.322 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.73 27.74 9.2 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.016 2.126 . . . . 0.0 114.372 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 78.6 p -64.05 -17.46 63.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.367 1.467 . . . . 0.0 114.354 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 75.56 15.43 2.7 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.095 2.558 . . . . 0.0 113.337 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -132.12 157.86 43.14 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.049 0.94 . . . . 0.0 112.41 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 34.4 pt -135.85 163.11 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.529 1.531 . . . . 0.0 111.55 165.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -82.18 146.65 29.44 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.038 1.335 . . . . 0.0 110.998 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.06 -31.08 68.55 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.944 -1.098 . . . . 0.0 113.402 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 62.2 p -65.49 -14.74 61.66 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.469 1.908 . . . . 0.0 114.835 176.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.8 m -119.83 -14.05 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.499 1.12 . . . . 0.0 113.439 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -40.09 79.46 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.972 -1.08 . . . . 0.0 112.171 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 57.5 p -62.94 -27.62 69.51 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -85.19 -34.69 22.01 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.096 -1.002 . . . . 0.0 112.647 172.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.06 -48.28 82.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.077 1.351 . . . . 0.0 111.454 169.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.6 -29.94 53.18 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.502 1.521 . . . . 0.0 113.578 174.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.83 -7.26 40.78 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 126.174 1.79 . . . . 0.0 114.041 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.1 -18.34 23.7 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.552 -1.342 . . . . 0.0 113.087 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.3 mt -70.75 163.9 26.24 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.473 1.909 . . . . 0.0 112.347 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 54.4 m -84.33 158.21 21.24 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.659 0.784 . . . . 0.0 110.47 163.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.87 149.82 79.34 Favored Pre-proline 0 CA--C 1.548 0.898 0 O-C-N 120.698 -1.252 . . . . 0.0 110.781 167.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -85.43 -7.35 51.53 Favored 'Cis proline' 0 CA--C 1.547 1.136 0 N-CA-C 115.641 1.362 . . . . 0.0 115.641 0.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.41 -24.66 63.87 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.567 1.076 . . . . 0.0 113.247 -178.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -49.41 128.04 16.36 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 127.514 2.326 . . . . 0.0 113.134 169.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.61 91.48 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.491 1.516 . . . . 0.0 107.392 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.41 145.72 55.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 41.7 mttt -63.0 149.78 89.71 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.376 1.07 . . . . 0.0 112.645 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.33 127.81 12.05 Favored 'Cis proline' 0 CA--C 1.543 0.947 0 CA-C-N 118.978 0.671 . . . . 0.0 111.55 -9.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 43.3 p30 -121.23 -2.32 9.61 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.123 1.369 . . . . 0.0 114.487 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -55.32 -40.92 71.75 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 119.827 1.194 . . . . 0.0 112.594 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 37.3 mm -68.81 -42.53 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.988 0.915 . . . . 0.0 110.873 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 21.0 m -57.49 -43.24 84.0 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.311 1.444 . . . . 0.0 112.383 175.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 72.6 mt -72.81 -37.04 67.65 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.788 1.635 . . . . 0.0 112.936 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 44.8 mt -60.14 -33.62 54.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.619 1.168 . . . . 0.0 111.929 171.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -74.62 -11.09 60.1 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 58.7 mtt -81.58 178.99 8.02 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.663 1.12 . . . . 0.0 112.084 170.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 24.8 t70 -114.43 27.71 9.27 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.356 1.862 . . . . 0.0 112.636 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 97.0 mt -52.79 117.92 12.15 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 126.471 1.908 . . . . 0.0 112.374 -175.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -74.73 107.85 2.56 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 124.07 3.18 . . . . 0.0 112.369 -175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.0 mtt -73.13 92.56 1.72 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.679 0.792 . . . . 0.0 110.393 168.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.6 m -65.29 -33.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -162.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 56.9 m -138.06 2.86 2.38 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.239 1.416 . . . . 0.0 113.773 -175.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 150.79 -59.73 0.42 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.187 1.375 . . . . 0.0 112.219 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -147.8 13.17 1.02 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -100.46 151.41 21.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.244 1.017 . . . . 0.0 112.129 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.8 mp -139.4 133.43 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.022 1.329 . . . . 0.0 110.191 -171.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -78.68 140.0 38.42 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.853 2.061 . . . . 0.0 113.485 -173.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 24.6 p -53.79 -47.64 70.59 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.836 1.654 . . . . 0.0 114.755 -173.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.5 tpt -68.35 -37.36 80.41 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.801 -0.562 . . . . 0.0 112.366 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -71.36 -31.38 67.27 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.378 -0.827 . . . . 0.0 112.136 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.62 -50.89 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.202 1.001 . . . . 0.0 110.231 168.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.24 -45.68 76.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.972 0.909 . . . . 0.0 112.249 175.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . 0.41 ' CE2' ' HE3' ' A' 1859 ' ' LYS . 34.9 t80 -55.18 -55.13 34.74 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.706 1.603 . . . . 0.0 110.945 174.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.18 -43.85 87.73 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.256 -0.903 . . . . 0.0 112.991 177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -69.38 -38.78 78.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.843 0.857 . . . . 0.0 112.739 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 40.3 p -77.43 -32.47 54.65 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' 1855 ' ' PHE . 0.7 OUTLIER -60.78 -28.38 68.7 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.555 1.142 . . . . 0.0 113.425 178.491 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 20.9 mtp-105 -54.12 -57.65 10.32 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.514 1.526 . . . . 0.0 111.515 164.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 3.1 t -63.94 -40.86 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 127.03 2.132 . . . . 0.0 111.696 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 36.0 mt -71.12 -9.07 57.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.862 1.665 . . . . 0.0 113.827 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 82.54 8.41 86.19 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.505 1.526 . . . . 0.0 114.667 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.37 -19.01 47.34 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.277 1.431 . . . . 0.0 113.395 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.252 1.217 0 C-N-CA 127.144 2.178 . . . . 0.0 112.317 179.168 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 CA-C-O 119.717 -0.491 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -58.25 -21.32 51.62 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.669 3.579 . . . . 0.0 116.133 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 91.52 -6.16 80.35 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 125.184 1.373 . . . . 0.0 114.963 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 40.3 t -68.32 152.86 44.83 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.025 0.93 . . . . 0.0 111.589 170.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.84 -18.32 59.6 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.164 -0.96 . . . . 0.0 113.567 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.72 -33.85 75.96 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.372 1.069 . . . . 0.0 112.548 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 65.2 t80 -70.78 -35.68 72.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.852 0.861 . . . . 0.0 111.777 173.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 16.0 m -67.39 -9.01 37.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.874 1.67 . . . . 0.0 114.943 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 90.6 t -61.25 -19.67 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 126.089 1.756 . . . . 0.0 112.589 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.31 -7.66 10.28 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.189 1.796 . . . . 0.0 115.275 171.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 47.7 m -131.51 151.66 51.38 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.286 2.234 . . . . 0.0 110.604 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 66.65 -44.37 0.43 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 129.006 2.922 . . . . 0.0 114.669 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.62 2.64 0.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 128.063 2.545 . . . . 0.0 117.528 162.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 22.6 t -149.5 160.08 43.76 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.793 1.237 . . . . 0.0 112.797 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 70.9 p -131.04 4.75 4.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.265 2.226 . . . . 0.0 112.596 173.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -94.89 158.04 35.72 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.915 1.686 . . . . 0.0 113.456 -171.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.41 -5.75 15.83 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 123.978 3.118 . . . . 0.0 114.452 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 75.6 mt -125.16 155.68 39.58 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 127.111 2.164 . . . . 0.0 110.75 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.1 t -139.42 173.4 11.58 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.512 1.525 . . . . 0.0 111.936 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.3 -33.67 63.46 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.991 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.5 t70 -60.51 -34.03 73.48 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.54 1.136 . . . . 0.0 113.396 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -69.83 -46.06 66.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.599 0.76 . . . . 0.0 111.33 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -66.44 -38.46 87.45 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.422 1.089 . . . . 0.0 112.093 176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -60.2 -48.26 82.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.865 0.866 . . . . 0.0 111.671 172.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -56.7 -45.15 82.0 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.509 1.123 . . . . 0.0 112.156 172.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -55.57 -56.28 22.2 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 118.955 0.798 . . . . 0.0 112.44 176.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -68.27 -30.09 69.03 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.339 1.236 . . . . 0.0 114.339 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.87 -46.52 87.5 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.873 1.215 . . . . 0.0 111.829 172.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -70.48 -35.36 61.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.042 0.937 . . . . 0.0 111.955 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -53.52 -45.32 69.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.727 1.211 . . . . 0.0 113.377 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -62.76 -16.95 60.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.3 mttt -70.87 -24.73 62.56 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.488 1.115 . . . . 0.0 112.705 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -108.68 -21.11 12.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.342 1.857 . . . . 0.0 112.974 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 30.1 t0 -125.9 71.67 68.6 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.302 1.841 . . . . 0.0 110.887 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.03 -18.76 27.28 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.36 2.707 . . . . 0.0 112.669 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -79.92 -7.91 59.02 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.444 1.497 . . . . 0.0 113.34 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.86 23.02 6.1 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.552 2.341 . . . . 0.0 115.216 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 70.3 p -68.87 -11.29 60.37 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 69.2 mm-40 74.48 19.08 2.78 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.63 2.372 . . . . 0.0 113.778 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -130.86 149.59 52.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.659 0.784 . . . . 0.0 112.91 173.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.51 163.12 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.81 1.644 . . . . 0.0 111.494 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -80.48 150.51 29.67 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.871 1.268 . . . . 0.0 112.349 173.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.15 -35.15 71.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.329 1.052 . . . . 0.0 112.453 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 37.0 m -65.07 -13.52 58.19 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.073 1.749 . . . . 0.0 114.82 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 32.7 m -119.7 -16.1 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.428 1.091 . . . . 0.0 113.386 172.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.4 tt -55.19 -43.19 74.17 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.835 1.254 . . . . 0.0 111.287 169.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.1 p -62.9 -24.66 67.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 174.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -86.84 -38.6 16.65 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.078 -1.013 . . . . 0.0 112.162 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 39.0 t80 -57.32 -45.59 84.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.48 1.512 . . . . 0.0 112.171 168.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -53.49 -31.49 46.11 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.732 1.613 . . . . 0.0 113.17 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -96.42 -3.16 44.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.006 1.722 . . . . 0.0 114.362 177.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.93 -20.31 21.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.876 -1.14 . . . . 0.0 113.271 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.2 mt -69.49 165.18 21.5 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.392 1.877 . . . . 0.0 112.677 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.9 t -91.22 160.44 15.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.848 0.859 . . . . 0.0 110.874 164.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.59 151.15 84.48 Favored Pre-proline 0 CA--C 1.548 0.894 0 O-C-N 120.992 -1.067 . . . . 0.0 111.013 171.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -83.67 -9.04 46.85 Favored 'Cis proline' 0 CA--C 1.542 0.893 0 N-CA-C 114.828 1.049 . . . . 0.0 114.828 -0.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 47.0 mt -67.79 -27.97 67.2 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.588 1.085 . . . . 0.0 112.988 -175.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -43.3 140.65 1.52 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 127.836 2.455 . . . . 0.0 113.28 169.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.27 92.32 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.94 1.696 . . . . 0.0 107.685 162.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.77 142.6 57.18 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.543 0.737 . . . . 0.0 112.87 -176.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.6 mttt -64.93 148.76 97.37 Favored Pre-proline 0 N--CA 1.482 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 112.415 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.74 131.24 19.79 Favored 'Cis proline' 0 CA--C 1.539 0.732 0 CA-C-N 118.906 0.645 . . . . 0.0 111.727 -8.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 38.4 p30 -121.34 -6.46 9.33 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.013 1.325 . . . . 0.0 114.404 -173.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -53.92 -42.63 68.97 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.805 1.242 . . . . 0.0 113.075 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.86 -41.76 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 110.999 176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.0 t -61.03 -48.84 79.93 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.401 0.681 . . . . 0.0 111.539 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.06 -33.51 75.91 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.104 1.362 . . . . 0.0 112.839 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.8 mt -66.22 -37.85 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.063 1.345 . . . . 0.0 111.315 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -16.69 61.14 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.1 mtt -73.34 170.92 14.03 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.747 1.158 . . . . 0.0 111.837 168.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -109.79 25.84 11.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.959 1.704 . . . . 0.0 112.814 -176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 58.4 mt -47.51 111.3 1.61 Allowed Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 127.335 2.254 . . . . 0.0 112.683 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -78.42 106.4 2.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.856 3.704 . . . . 0.0 112.143 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 1.2 mpt? -62.73 148.57 46.25 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.035 -1.04 . . . . 0.0 112.087 169.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 35.9 m -111.17 -21.97 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 126.097 1.759 . . . . 0.0 113.618 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 22.9 m -134.52 9.81 3.7 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.917 1.687 . . . . 0.0 113.782 -177.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 96.16 -25.51 25.31 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 126.437 1.97 . . . . 0.0 114.434 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 20.9 t70 -140.37 0.97 1.74 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.222 1.409 . . . . 0.0 114.066 175.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -115.44 148.65 39.15 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.739 1.616 . . . . 0.0 110.861 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.6 mp -139.08 138.76 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.192 1.797 . . . . 0.0 110.31 -165.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -79.47 137.76 37.34 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.322 1.449 . . . . 0.0 114.502 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.8 t -46.84 -57.36 4.98 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.957 2.503 . . . . 0.0 114.686 -176.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 11.4 tpt -62.53 -35.36 79.18 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.316 0.646 . . . . 0.0 112.292 -177.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.16 -33.78 65.66 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.36 -0.837 . . . . 0.0 112.481 178.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.09 -50.83 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.72 1.208 . . . . 0.0 109.613 168.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.0 tp -54.17 -51.5 64.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.818 0.847 . . . . 0.0 111.751 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 46.7 t80 -57.2 -43.56 82.85 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.628 1.571 . . . . 0.0 112.399 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -63.95 -40.6 96.81 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.481 -0.762 . . . . 0.0 112.786 173.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -69.79 -41.05 75.6 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.955 0.902 . . . . 0.0 113.269 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -73.96 -25.52 59.99 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 41.5 mttm -51.6 -38.59 55.29 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.416 1.486 . . . . 0.0 114.281 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -55.71 -51.49 67.13 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.49 1.516 . . . . 0.0 111.633 173.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 2.3 t -69.19 -39.06 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 127.181 2.192 . . . . 0.0 111.596 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 83.4 mt -71.22 -11.29 60.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.686 1.594 . . . . 0.0 114.08 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 77.53 18.49 77.62 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.061 1.315 . . . . 0.0 114.904 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -102.75 88.24 3.16 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.316 1.847 . . . . 0.0 111.478 -171.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 46.4 p . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.641 1.576 . . . . 0.0 114.616 174.461 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 CA-C-O 119.284 -0.731 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -55.43 173.15 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 125.239 3.96 . . . . 0.0 114.889 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -60.21 -15.14 36.12 Favored Glycine 0 CA--C 1.54 1.644 0 C-N-CA 124.626 1.107 . . . . 0.0 115.648 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.5 p -66.31 -9.75 36.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.088 1.755 . . . . 0.0 114.582 171.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -58.66 -33.07 69.69 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.88 1.672 . . . . 0.0 113.205 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.01 118.71 6.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.998 1.719 . . . . 0.0 113.357 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 43.3 p90 -70.99 -2.21 14.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.239 1.416 . . . . 0.0 113.702 166.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 6.0 m -59.58 -8.79 2.11 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.253 2.621 . . . . 0.0 116.539 -170.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 32.8 m -60.04 -12.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.619 1.968 . . . . 0.0 114.46 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -70.61 -6.51 37.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.408 1.883 . . . . 0.0 114.992 172.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.9 p -123.44 177.7 5.51 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.777 1.631 . . . . 0.0 113.389 -172.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -130.9 138.52 49.83 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.184 1.793 . . . . 0.0 111.73 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -75.62 -13.89 60.35 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.045 1.338 . . . . 0.0 114.53 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 3.5 t 64.23 -13.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 128.37 2.668 . . . . 0.0 116.04 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 3.8 m 47.04 58.16 5.05 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.592 2.757 . . . . 0.0 113.55 169.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.12 153.21 96.27 Favored Pre-proline 0 N--CA 1.478 0.949 0 O-C-N 120.973 -1.079 . . . . 0.0 111.39 167.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.55 -20.22 18.21 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.765 2.31 . . . . 0.0 113.947 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.7 mt -134.52 152.65 51.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.036 1.734 . . . . 0.0 111.649 -176.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 10.4 t -143.41 177.47 8.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.826 2.051 . . . . 0.0 111.308 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.53 -35.21 65.4 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.444 1.497 . . . . 0.0 113.017 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.44 -31.04 71.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.153 1.381 . . . . 0.0 113.69 177.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -71.12 -36.8 72.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.186 -0.946 . . . . 0.0 112.325 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -68.6 -39.37 80.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.682 0.793 . . . . 0.0 111.356 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.36 -46.66 87.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.849 0.86 . . . . 0.0 112.151 171.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 62.5 ttp -54.91 -45.09 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.979 1.312 . . . . 0.0 112.28 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 35.1 t80 -50.64 -55.79 14.81 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.789 0.722 . . . . 0.0 111.415 176.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -74.09 -25.43 59.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -178.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.14 -43.1 96.26 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.046 -1.034 . . . . 0.0 112.063 169.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -76.07 -28.51 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.566 1.146 . . . . 0.0 112.147 175.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.89 -45.37 82.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.784 1.233 . . . . 0.0 113.528 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.99 -15.84 60.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -71.26 -18.97 62.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.921 1.689 . . . . 0.0 112.883 173.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -121.79 -21.33 6.13 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.582 1.953 . . . . 0.0 113.698 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -123.3 67.45 35.77 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.418 1.887 . . . . 0.0 110.716 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.89 -20.56 38.91 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.898 2.399 . . . . 0.0 112.591 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -72.4 -11.72 60.81 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.893 1.677 . . . . 0.0 113.425 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.94 30.58 11.89 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.836 2.054 . . . . 0.0 114.001 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 69.6 p -63.97 -17.53 63.38 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 73.34 16.35 4.12 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.517 2.727 . . . . 0.0 113.946 -173.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -135.18 158.72 43.64 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.119 0.968 . . . . 0.0 111.64 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.2 pt -132.13 163.21 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.19 1.396 . . . . 0.0 110.794 168.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -77.85 151.51 33.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.582 0.753 . . . . 0.0 111.817 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 6.1 t80 -59.09 -28.58 66.63 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.818 -1.176 . . . . 0.0 112.469 170.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.7 m -62.74 -17.57 61.13 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.804 2.042 . . . . 0.0 115.063 174.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.6 m -121.98 -12.32 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 124.767 1.227 . . . . 0.0 113.831 175.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 32.6 tp -51.04 -43.2 60.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.569 1.548 . . . . 0.0 112.552 172.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 54.0 p -67.14 -21.95 65.8 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.99 -35.85 15.29 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.721 0.808 . . . . 0.0 111.526 172.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 56.1 t80 -58.33 -49.31 77.64 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 111.786 168.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.2 -27.19 53.79 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.891 1.276 . . . . 0.0 113.375 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.53 -2.52 44.94 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.824 1.65 . . . . 0.0 114.13 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.6 -17.5 21.32 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.768 -1.208 . . . . 0.0 113.069 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -73.17 170.5 14.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.123 2.169 . . . . 0.0 112.298 175.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.4 t -101.99 163.35 12.29 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.084 0.954 . . . . 0.0 110.945 165.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -62.61 150.71 85.67 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 121.379 -0.826 . . . . 0.0 111.556 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -84.11 -8.59 48.01 Favored 'Cis proline' 0 CA--C 1.543 0.952 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -1.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.52 -27.37 68.41 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.4 1.0 . . . . 0.0 113.237 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -53.01 124.62 14.79 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.465 2.306 . . . . 0.0 112.473 170.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -110.7 88.72 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 125.278 1.431 . . . . 0.0 107.566 163.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.17 146.1 54.84 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.533 0.733 . . . . 0.0 112.855 -174.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.42 148.29 93.85 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 123.935 0.894 . . . . 0.0 112.782 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.0 128.82 14.55 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 119.13 0.725 . . . . 0.0 111.819 -9.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.1 p30 -118.5 7.38 11.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.506 1.523 . . . . 0.0 114.386 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -48.83 -65.01 0.64 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.418 1.487 . . . . 0.0 112.254 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 97.8 mt -68.95 -29.9 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.123 0.969 . . . . 0.0 109.984 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.1 m -61.14 -49.84 75.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.299 1.439 . . . . 0.0 111.702 175.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 56.3 mt -70.06 -35.06 73.97 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.264 1.426 . . . . 0.0 112.817 176.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 68.2 mt -58.91 -35.29 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 118.988 0.813 . . . . 0.0 111.362 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -77.29 -6.18 52.2 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 17.6 mmt -73.25 165.45 25.02 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 120.091 1.314 . . . . 0.0 111.583 172.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.39 0.95 30.98 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.744 1.618 . . . . 0.0 114.772 -178.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.8 121.78 52.21 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 126.431 1.892 . . . . 0.0 114.007 -165.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -78.07 -173.35 1.79 Allowed 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 123.504 2.803 . . . . 0.0 110.806 162.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 2.7 mpt? -130.75 140.82 50.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.288 1.035 . . . . 0.0 110.135 163.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.7 m -82.1 -19.84 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.7 p -126.14 -8.41 6.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.834 2.054 . . . . 0.0 114.127 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.84 -12.1 67.51 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 125.702 1.62 . . . . 0.0 113.825 -163.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.6 p30 -143.74 -12.16 0.67 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -109.59 152.22 25.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.32 1.448 . . . . 0.0 112.182 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.03 131.72 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 126.357 1.863 . . . . 0.0 109.958 -172.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -74.37 141.79 45.11 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.287 1.835 . . . . 0.0 114.007 -175.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.7 p -52.11 -52.46 51.35 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.425 1.49 . . . . 0.0 114.385 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -32.89 74.73 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.87 -39.78 72.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.347 0.659 . . . . 0.0 111.249 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 52.8 mt -62.55 -52.09 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.503 1.121 . . . . 0.0 110.493 171.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.75 -55.45 22.72 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.323 1.049 . . . . 0.0 110.918 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 88.0 t80 -55.03 -50.06 70.01 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.579 1.152 . . . . 0.0 112.758 177.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.51 -45.05 85.41 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.099 0.863 . . . . 0.0 112.456 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -64.39 -48.71 74.41 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.96 0.904 . . . . 0.0 111.545 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 64.4 p -67.51 -44.37 78.6 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.159 0.891 . . . . 0.0 111.399 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 63.9 tttp -48.89 -51.62 28.89 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 126.529 1.932 . . . . 0.0 112.297 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -63.57 -44.59 93.64 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.804 1.642 . . . . 0.0 112.63 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -59.82 -46.01 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.955 1.302 . . . . 0.0 112.262 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.21 -14.38 62.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.658 1.583 . . . . 0.0 113.511 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 68.5 18.99 72.35 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 124.83 1.205 . . . . 0.0 114.014 -175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -84.78 68.79 10.58 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.165 1.386 . . . . 0.0 111.573 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.723 2.009 . . . . 0.0 113.475 -179.336 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.588 0 CA-C-O 118.154 -1.359 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -54.18 157.16 11.66 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.462 3.442 . . . . 0.0 114.814 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -103.42 15.91 53.19 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 126.197 1.856 . . . . 0.0 115.075 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 23.6 m -54.26 142.81 24.99 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.185 1.794 . . . . 0.0 113.567 -173.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -67.07 168.17 10.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.765 1.226 . . . . 0.0 113.698 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.27 173.37 15.1 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.934 1.694 . . . . 0.0 111.526 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -177.34 0.38 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.457 1.103 . . . . 0.0 113.009 164.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 18.5 t -66.56 98.08 0.48 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.912 -1.117 . . . . 0.0 111.145 170.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.2 m -71.53 -10.92 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.796 1.638 . . . . 0.0 114.555 -176.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -65.88 153.16 42.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.964 1.306 . . . . 0.0 112.841 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.2 m -64.64 126.65 28.58 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.128 1.371 . . . . 0.0 110.968 177.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -70.85 -9.61 57.93 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -127.83 118.81 24.39 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.383 1.873 . . . . 0.0 110.656 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 24.5 m -72.69 -2.37 19.93 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.91 1.684 . . . . 0.0 115.346 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 56.6 p 41.67 57.63 3.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.684 2.393 . . . . 0.0 113.978 -177.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -62.94 151.99 84.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.382 1.473 . . . . 0.0 113.243 -175.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.53 -4.83 15.03 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.039 3.159 . . . . 0.0 114.733 -174.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 57.6 mt -126.07 153.67 44.14 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.448 1.499 . . . . 0.0 112.463 -172.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.5 t -144.54 -179.47 6.57 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.04 -35.65 67.12 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.09 1.756 . . . . 0.0 112.92 -178.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.11 -30.62 71.74 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.476 1.11 . . . . 0.0 113.421 177.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -72.43 -37.89 68.47 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.039 -1.038 . . . . 0.0 111.637 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -67.42 -42.24 83.53 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.314 0.646 . . . . 0.0 111.09 173.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.04 -43.58 91.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.072 0.949 . . . . 0.0 112.221 172.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 65.6 ttp -58.38 -47.94 82.24 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 0.0 112.136 172.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.0 t80 -54.52 -51.86 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.26 0.624 . . . . 0.0 111.671 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -64.07 -35.8 81.92 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.29 -44.8 95.06 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.261 -0.899 . . . . 0.0 112.319 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.2 mm -73.3 -35.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.546 0.739 . . . . 0.0 111.965 175.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 60.5 t-105 -53.54 -48.33 69.19 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.229 1.411 . . . . 0.0 113.363 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.81 -14.99 57.64 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.71 -28.01 65.47 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.234 1.014 . . . . 0.0 112.287 171.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -103.88 -21.21 13.68 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.511 1.924 . . . . 0.0 113.047 177.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.1 t0 -122.72 74.94 46.08 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.59 1.956 . . . . 0.0 111.431 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.07 -16.78 32.05 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.156 2.571 . . . . 0.0 113.023 177.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.35 -13.18 59.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.556 1.542 . . . . 0.0 113.43 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.28 24.89 3.07 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.598 1.959 . . . . 0.0 113.571 -167.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.4 t -69.39 -9.33 53.04 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.901 1.28 . . . . 0.0 114.042 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 64.43 28.24 13.56 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.345 2.258 . . . . 0.0 113.218 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -134.78 145.04 48.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.285 1.834 . . . . 0.0 110.782 170.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.3 pt -134.78 162.59 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.028 1.331 . . . . 0.0 110.952 166.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -80.02 151.23 30.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.354 1.061 . . . . 0.0 112.336 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.82 -32.63 71.99 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.193 -0.942 . . . . 0.0 112.901 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 65.0 p -63.33 -15.68 58.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.229 1.812 . . . . 0.0 115.05 176.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.5 m -118.13 -14.79 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.433 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.61 -41.43 81.26 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.601 1.16 . . . . 0.0 111.494 174.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 58.9 p -64.6 -27.63 69.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -84.0 -35.38 23.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.931 0.787 . . . . 0.0 112.257 172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.6 t80 -60.3 -45.28 93.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.812 1.245 . . . . 0.0 111.859 170.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.68 -28.85 57.82 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.278 1.431 . . . . 0.0 113.392 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 38.3 t70 -97.49 -5.39 36.06 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.451 1.901 . . . . 0.0 114.093 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.67 -21.24 24.03 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.559 -1.338 . . . . 0.0 112.579 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.22 160.9 28.29 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.187 1.795 . . . . 0.0 112.233 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.0 t -90.22 162.55 15.18 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.677 0.751 . . . . 0.0 110.618 163.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.28 152.28 73.18 Favored Pre-proline 0 CA--C 1.554 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 111.12 172.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -84.44 -11.74 41.89 Favored 'Cis proline' 0 CA--C 1.546 1.098 0 N-CA-C 114.956 1.098 . . . . 0.0 114.956 0.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.15 -31.55 72.72 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.777 1.171 . . . . 0.0 113.324 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -43.52 130.59 5.17 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.458 2.703 . . . . 0.0 113.787 175.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.72 87.93 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 107.375 165.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -63.23 147.46 50.91 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.638 0.775 . . . . 0.0 113.056 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 42.9 mttt -65.41 150.77 95.42 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.444 1.098 . . . . 0.0 112.52 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -71.25 132.01 22.87 Favored 'Cis proline' 0 CA--C 1.542 0.884 0 CA-C-N 118.842 0.622 . . . . 0.0 111.656 -9.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 45.5 p30 -124.06 0.37 8.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.04 1.336 . . . . 0.0 114.379 -174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -56.77 -40.56 76.08 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.786 -1.196 . . . . 0.0 112.751 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 43.6 mm -70.04 -43.81 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.416 1.087 . . . . 0.0 110.663 177.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 23.6 m -54.38 -47.09 73.08 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.536 1.535 . . . . 0.0 112.005 175.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 82.6 mt -72.38 -37.61 68.7 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.588 1.555 . . . . 0.0 113.254 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.86 -37.37 59.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.373 1.069 . . . . 0.0 111.516 171.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -76.09 -11.5 59.95 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 63.9 mtt -76.39 165.47 24.8 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 120.141 1.337 . . . . 0.0 112.408 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.59 10.79 8.3 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.196 1.798 . . . . 0.0 113.876 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 94.5 mt -49.88 121.38 12.63 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.563 1.945 . . . . 0.0 113.084 -173.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.99 177.76 8.15 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 124.003 3.135 . . . . 0.0 112.288 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 54.9 mtt -135.13 103.82 5.69 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.554 1.142 . . . . 0.0 110.894 167.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.5 m -70.82 -24.73 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 125.022 1.329 . . . . 0.0 113.931 -173.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 46.8 m -130.31 4.82 4.78 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.566 1.947 . . . . 0.0 113.459 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 88.67 -6.9 83.17 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 126.111 1.815 . . . . 0.0 114.328 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 31.1 p30 -146.42 -2.57 0.67 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 177.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -127.44 153.02 46.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.14 1.776 . . . . 0.0 112.397 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.87 136.07 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.376 1.47 . . . . 0.0 110.716 -166.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -75.85 137.67 40.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.156 1.782 . . . . 0.0 114.33 -175.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.8 t -48.64 -55.63 10.72 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 127.474 2.31 . . . . 0.0 113.896 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.0 tpt -64.49 -36.22 83.49 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.599 -0.688 . . . . 0.0 112.59 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -68.47 -36.92 79.64 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.519 -0.738 . . . . 0.0 111.976 177.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 59.0 mt -64.7 -47.7 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.847 0.859 . . . . 0.0 110.781 171.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.43 -51.29 67.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.427 0.691 . . . . 0.0 111.034 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 64.4 t80 -57.28 -42.34 81.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.318 1.447 . . . . 0.0 113.228 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.06 -45.26 89.6 Favored 'General case' 0 CA--C 1.547 0.858 0 O-C-N 121.102 -0.999 . . . . 0.0 112.581 172.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -70.74 -35.25 72.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.281 -0.887 . . . . 0.0 112.123 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 72.3 p -68.31 -38.39 81.55 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.07 1.304 . . . . 0.0 112.447 171.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 56.5 mttm -57.41 -38.72 74.76 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 119.647 1.112 . . . . 0.0 113.151 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -23.89 66.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.07 1.748 . . . . 0.0 113.847 170.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 64.1 t -85.92 -44.43 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.728 1.211 . . . . 0.0 111.367 171.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.62 -16.0 63.3 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.172 1.789 . . . . 0.0 113.5 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 91.12 13.44 58.87 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.518 1.532 . . . . 0.0 114.364 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -81.9 7.09 13.84 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 125.088 1.355 . . . . 0.0 113.832 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.256 1.439 0 C-N-CA 128.232 2.613 . . . . 0.0 114.385 177.363 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.342 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -56.06 -22.09 37.61 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 124.461 3.441 . . . . 0.0 116.991 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -80.45 60.78 4.51 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.638 1.589 . . . . 0.0 113.673 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -74.25 61.19 0.86 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 112.9 176.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.96 -3.22 18.27 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.34 1.856 . . . . 0.0 114.885 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.95 164.56 2.84 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.394 1.878 . . . . 0.0 114.147 175.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 70.8 t80 -65.35 159.68 23.51 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.666 1.187 . . . . 0.0 112.412 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 25.2 m -67.11 157.16 34.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.162 1.385 . . . . 0.0 113.941 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 34.6 m -82.63 -12.14 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -73.91 164.58 26.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.389 1.475 . . . . 0.0 113.385 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 61.0 m -138.38 -54.99 0.63 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.861 1.665 . . . . 0.0 111.928 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.11 167.08 22.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.656 1.582 . . . . 0.0 112.643 -178.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -83.4 -4.65 58.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 2.5 t 56.27 35.28 25.52 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.76 2.024 . . . . 0.0 113.148 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 97.9 m -122.83 94.24 4.21 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 127.046 2.138 . . . . 0.0 109.486 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.5 144.46 88.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.487 1.115 . . . . 0.0 112.14 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -83.18 -6.56 11.14 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.965 3.11 . . . . 0.0 114.417 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 84.1 mt -128.37 160.07 33.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.913 2.085 . . . . 0.0 111.464 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 58.2 m -136.88 169.68 17.35 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.59 1.956 . . . . 0.0 111.626 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -56.96 -35.25 68.91 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.552 1.141 . . . . 0.0 113.851 -175.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -66.91 -18.89 65.6 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -70.66 -40.65 72.89 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.111 0.869 . . . . 0.0 111.336 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -67.36 -43.24 81.95 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.714 0.806 . . . . 0.0 110.981 173.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.3 t70 -58.84 -42.37 89.16 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.49 -0.756 . . . . 0.0 112.433 174.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.1 tmm? -58.7 -46.1 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.801 1.241 . . . . 0.0 111.933 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 31.9 t80 -56.38 -53.97 51.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.887 0.767 . . . . 0.0 112.133 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.16 -30.51 71.57 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.564 0.949 . . . . 0.0 113.564 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.05 -52.17 51.49 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.95 -1.094 . . . . 0.0 111.831 172.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.16 -30.17 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.708 0.803 . . . . 0.0 111.775 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -54.54 -36.88 64.77 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.315 1.446 . . . . 0.0 113.139 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -59.69 -23.53 63.2 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.053 1.341 . . . . 0.0 113.682 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 64.7 mttm -71.35 -21.61 62.01 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.877 1.271 . . . . 0.0 113.494 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -116.29 -24.04 8.12 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.224 1.81 . . . . 0.0 113.315 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 18.7 t0 -127.08 68.35 71.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.302 1.841 . . . . 0.0 110.821 172.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.78 -17.95 37.17 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.946 2.43 . . . . 0.0 112.706 177.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.17 -7.47 55.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.087 1.755 . . . . 0.0 113.357 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 55.78 25.81 8.81 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.404 2.281 . . . . 0.0 114.762 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 71.6 p -64.65 -15.77 61.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.699 1.599 . . . . 0.0 114.409 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 70.67 17.69 6.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.534 2.334 . . . . 0.0 113.881 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -129.67 150.58 50.93 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.161 0.985 . . . . 0.0 112.719 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.54 162.23 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.53 1.532 . . . . 0.0 111.143 164.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -81.29 151.5 28.03 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.579 1.152 . . . . 0.0 112.481 175.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.29 -33.25 70.86 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.346 -0.846 . . . . 0.0 113.17 -178.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 58.4 p -65.61 -19.92 66.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.424 1.889 . . . . 0.0 114.612 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.8 m -111.8 -14.46 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.731 1.212 . . . . 0.0 113.239 176.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.17 -38.68 71.25 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.652 1.181 . . . . 0.0 111.272 168.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 19.9 m -56.47 -38.86 72.28 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.309 1.443 . . . . 0.0 113.493 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 8.6 t70 -83.72 -35.33 24.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.691 0.796 . . . . 0.0 112.934 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.15 -46.27 88.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.655 1.182 . . . . 0.0 112.268 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.91 -27.42 52.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.615 1.166 . . . . 0.0 113.521 173.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -97.91 0.84 47.29 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.422 1.889 . . . . 0.0 114.326 175.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -95.87 -19.36 19.63 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.396 -1.44 . . . . 0.0 113.241 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.52 164.51 26.31 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.36 1.864 . . . . 0.0 113.219 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 50.3 m -83.98 156.38 22.32 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.205 1.002 . . . . 0.0 111.24 164.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.32 154.25 54.13 Favored Pre-proline 0 CA--C 1.555 1.138 0 O-C-N 121.121 -0.987 . . . . 0.0 111.183 168.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.27 -9.67 45.5 Favored 'Cis proline' 0 CA--C 1.547 1.15 0 N-CA-C 115.389 1.265 . . . . 0.0 115.389 -2.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.79 -29.95 70.94 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.527 1.058 . . . . 0.0 113.28 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -46.47 128.1 9.83 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.556 2.342 . . . . 0.0 113.03 172.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 88.5 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.728 1.611 . . . . 0.0 108.121 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -58.52 135.87 57.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.643 0.777 . . . . 0.0 112.747 -173.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 74.0 mttt -62.53 150.87 84.85 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 123.793 0.837 . . . . 0.0 113.039 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.62 137.27 44.93 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 O-C-N 122.214 0.586 . . . . 0.0 111.77 -7.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 49.7 p30 -132.83 6.72 4.01 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -170.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -55.0 -37.44 66.59 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.522 -1.362 . . . . 0.0 114.023 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 86.0 mt -72.24 -41.01 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.669 1.188 . . . . 0.0 110.76 175.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 5.4 m -55.39 -47.58 75.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.445 1.498 . . . . 0.0 111.957 176.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.72 -41.17 96.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.174 0.99 . . . . 0.0 112.89 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 73.8 mt -58.14 -35.2 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.115 0.966 . . . . 0.0 111.168 173.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -79.57 -5.86 55.83 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.65 159.97 30.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.974 1.715 . . . . 0.0 112.173 170.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.0 t0 -102.09 84.9 2.57 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.41 1.484 . . . . 0.0 110.266 174.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 90.3 mt -119.97 134.63 24.0 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 125.415 1.486 . . . . 0.0 111.441 -173.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.35 171.9 17.37 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.219 2.613 . . . . 0.0 111.292 170.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 53.9 mtt -133.81 100.92 4.91 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.253 1.021 . . . . 0.0 109.968 167.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 32.8 m -65.19 -25.88 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.15 1.38 . . . . 0.0 113.831 -170.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 50.6 m -128.37 3.59 5.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.321 1.849 . . . . 0.0 113.661 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 94.67 -8.44 71.19 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 126.277 1.894 . . . . 0.0 114.288 -175.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -145.77 -4.89 0.64 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -125.82 150.05 48.13 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.402 1.881 . . . . 0.0 112.314 -176.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.76 132.97 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.553 1.541 . . . . 0.0 110.06 -165.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -73.16 139.3 46.27 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.067 1.347 . . . . 0.0 114.504 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -43.77 -62.21 1.18 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.659 2.784 . . . . 0.0 114.325 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 13.2 tpt -63.68 -36.73 84.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -174.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.98 -35.13 79.74 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.25 0.62 . . . . 0.0 112.387 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 60.8 mt -65.56 -49.24 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.339 1.056 . . . . 0.0 110.699 172.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 62.7 tp -53.14 -53.57 48.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.888 0.875 . . . . 0.0 111.255 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . 0.443 ' CZ ' ' HE2' ' A' 1859 ' ' LYS . 20.9 t80 -56.64 -45.61 81.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.415 1.486 . . . . 0.0 112.615 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.82 -40.59 93.3 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.658 0.783 . . . . 0.0 112.723 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -71.24 -48.52 50.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.507 0.723 . . . . 0.0 112.345 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 56.7 p -65.29 -32.5 74.19 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . 0.443 ' HE2' ' CZ ' ' A' 1855 ' ' PHE . 30.3 mttm -47.57 -45.68 27.32 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.316 1.446 . . . . 0.0 113.378 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.55 -49.73 71.89 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.323 1.049 . . . . 0.0 111.604 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.6 t -67.99 -41.1 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 126.097 1.759 . . . . 0.0 111.7 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 79.8 mt -68.57 -8.5 42.26 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.152 1.781 . . . . 0.0 114.401 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 95.98 16.42 38.6 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.792 1.187 . . . . 0.0 115.238 173.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.47 -22.0 66.83 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 118.923 1.362 . . . . 0.0 113.06 175.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 127.309 2.244 . . . . 0.0 112.27 -177.351 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 CA-C-O 119.8 -0.445 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -55.29 -29.77 69.01 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.628 3.552 . . . . 0.0 116.464 -173.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -122.59 9.56 9.27 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 125.734 1.635 . . . . 0.0 115.203 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 22.3 m -60.79 118.9 7.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.325 1.45 . . . . 0.0 113.316 -176.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -143.43 -60.02 0.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.643 1.177 . . . . 0.0 112.327 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.8 p30 -137.93 162.88 32.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 111.993 -179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -135.0 5.05 3.29 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.236 1.414 . . . . 0.0 113.972 -173.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.3 p -68.34 164.22 21.3 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.113 1.365 . . . . 0.0 113.422 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 31.6 m -77.57 -15.49 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -178.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -149.19 128.15 12.67 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.734 1.614 . . . . 0.0 111.928 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 7.5 t -64.34 -22.93 67.12 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.691 1.196 . . . . 0.0 114.21 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.28 -18.44 64.58 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -69.7 -6.17 29.93 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -176.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 94.3 p -128.59 3.69 5.55 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.102 1.761 . . . . 0.0 114.391 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 82.2 p -121.71 28.07 7.85 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 126.048 1.739 . . . . 0.0 113.402 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -54.36 147.63 27.26 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 126.122 1.769 . . . . 0.0 114.033 -176.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.44 -11.06 17.39 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.828 3.019 . . . . 0.0 114.986 -171.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 85.8 mt -133.08 162.14 32.53 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.241 1.816 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 9.9 t -140.98 175.12 9.87 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.313 1.845 . . . . 0.0 111.725 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.01 -35.13 66.47 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.228 1.411 . . . . 0.0 112.779 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -60.17 -32.73 71.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.12 1.368 . . . . 0.0 113.812 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.09 -37.63 75.47 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.75 0.82 . . . . 0.0 111.838 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -75.5 -40.41 57.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.883 0.873 . . . . 0.0 111.585 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.39 -45.75 84.17 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.129 0.972 . . . . 0.0 111.573 171.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 58.5 ttp -54.73 -53.23 57.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.737 1.215 . . . . 0.0 111.588 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -52.6 -54.47 32.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.655 0.661 . . . . 0.0 111.578 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -65.18 -31.98 73.43 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.26 -52.52 32.96 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.153 -0.967 . . . . 0.0 112.165 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.24 -33.88 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.662 1.185 . . . . 0.0 111.892 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -52.92 -44.67 67.17 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.651 1.58 . . . . 0.0 114.098 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -62.39 -18.53 61.81 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -69.87 -18.67 63.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.881 1.272 . . . . 0.0 113.388 173.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -120.6 -16.92 8.2 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.519 1.928 . . . . 0.0 113.296 -177.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.0 t0 -113.92 76.12 3.15 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.06 2.144 . . . . 0.0 111.0 169.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -70.94 -17.74 31.98 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.24 2.627 . . . . 0.0 113.194 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -79.43 -11.73 59.91 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.323 1.449 . . . . 0.0 113.22 174.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.87 21.22 0.91 Allowed 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 126.827 2.051 . . . . 0.0 114.384 -167.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 6.0 t -72.55 -9.99 59.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.661 1.585 . . . . 0.0 114.218 -172.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 72.6 20.52 3.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.306 2.242 . . . . 0.0 113.739 -176.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -134.82 141.65 46.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.082 1.753 . . . . 0.0 110.864 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 31.9 pt -131.14 157.2 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 124.367 1.067 . . . . 0.0 112.202 171.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -73.34 148.48 43.42 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.22 1.008 . . . . 0.0 112.028 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -60.01 -30.07 68.91 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.185 -0.947 . . . . 0.0 112.812 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 67.7 p -67.28 -14.43 62.91 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.56 1.944 . . . . 0.0 115.262 175.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 27.4 m -118.95 -16.51 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 124.529 1.132 . . . . 0.0 113.539 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.6 tt -56.33 -42.22 77.32 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.721 1.208 . . . . 0.0 111.316 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 61.1 p -61.88 -30.51 70.92 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 6.6 t70 -82.79 -37.09 25.0 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.275 -0.891 . . . . 0.0 112.37 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.3 t80 -57.36 -46.21 83.59 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.534 1.534 . . . . 0.0 112.327 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.26 -26.09 37.84 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.56 1.544 . . . . 0.0 113.348 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.72 -5.86 25.87 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.224 1.81 . . . . 0.0 113.957 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -86.66 -19.45 29.25 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.857 -1.152 . . . . 0.0 113.012 177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 166.75 22.99 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.179 2.192 . . . . 0.0 112.38 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.0 t -97.84 164.82 12.22 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.944 0.897 . . . . 0.0 111.3 166.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.71 152.39 81.97 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.005 0.922 . . . . 0.0 111.454 176.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -85.01 -7.36 51.52 Favored 'Cis proline' 0 CA--C 1.546 1.113 0 N-CA-C 114.866 1.064 . . . . 0.0 114.866 -0.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.23 -26.28 66.51 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.435 1.016 . . . . 0.0 113.575 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -51.06 131.76 27.34 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.824 2.45 . . . . 0.0 113.218 172.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -119.76 92.57 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.954 1.701 . . . . 0.0 107.52 165.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.83 137.12 58.23 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -173.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.84 149.65 92.72 Favored Pre-proline 0 N--CA 1.481 1.088 0 C-N-CA 123.284 0.634 . . . . 0.0 112.078 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.52 131.06 20.05 Favored 'Cis proline' 0 CA--C 1.543 0.96 0 CA-C-N 119.312 0.79 . . . . 0.0 111.381 -7.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 35.7 p30 -124.29 3.97 8.48 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.618 1.567 . . . . 0.0 114.063 -173.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -56.56 -40.85 75.87 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.572 1.078 . . . . 0.0 112.79 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.0 mm -70.47 -42.4 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.107 0.963 . . . . 0.0 111.028 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 14.6 m -55.18 -47.24 75.48 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.482 1.513 . . . . 0.0 112.092 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.62 -38.41 77.21 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.586 1.554 . . . . 0.0 112.634 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.7 mt -58.92 -34.85 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.994 0.815 . . . . 0.0 111.494 171.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -76.69 -11.51 59.86 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 53.7 mtt -80.54 176.77 9.49 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.76 1.164 . . . . 0.0 112.132 169.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 20.3 t0 -115.26 86.91 2.55 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.011 1.724 . . . . 0.0 110.497 172.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -107.49 110.15 62.81 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.76 1.624 . . . . 0.0 110.546 -173.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.94 103.28 1.63 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.485 3.457 . . . . 0.0 112.435 -172.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 67.4 mtt -72.02 93.33 1.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.046 0.938 . . . . 0.0 111.887 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 33.9 m -64.97 -26.2 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.393 1.477 . . . . 0.0 113.844 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 97.0 p -113.79 -6.71 13.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.467 1.907 . . . . 0.0 113.827 178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.34 -8.28 77.47 Favored Glycine 0 CA--C 1.542 1.725 0 C-N-CA 125.674 1.607 . . . . 0.0 113.93 -164.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 3.3 p30 -147.11 -11.37 0.43 Allowed 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -115.47 154.04 30.03 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.171 1.388 . . . . 0.0 112.114 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.3 137.35 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 126.165 1.786 . . . . 0.0 110.179 -168.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -73.79 137.29 43.8 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.232 1.813 . . . . 0.0 114.638 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 46.7 t -45.91 -60.74 2.07 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.706 2.402 . . . . 0.0 114.761 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 74.3 mmm -65.5 -30.22 70.96 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -75.33 -32.13 60.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.301 0.955 . . . . 0.0 112.567 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.4 mt -63.5 -48.51 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.801 0.84 . . . . 0.0 109.887 168.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.27 -44.14 79.46 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.826 -0.546 . . . . 0.0 111.614 173.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 20.7 t80 -60.15 -45.72 92.09 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.31 1.044 . . . . 0.0 112.186 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.9 89.14 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.477 175.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -75.81 -41.68 52.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.655 1.182 . . . . 0.0 111.971 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 38.2 p -65.26 -37.54 87.53 Favored 'General case' 0 N--CA 1.482 1.135 0 O-C-N 121.017 -1.052 . . . . 0.0 112.019 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 80.3 mttt -55.79 -34.84 65.65 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.458 1.026 . . . . 0.0 113.381 168.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -35.9 81.37 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.657 1.583 . . . . 0.0 112.8 174.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 14.5 t -72.98 -49.92 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 125.441 1.497 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 71.4 mt -69.9 -20.89 63.35 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.725 1.61 . . . . 0.0 114.342 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 84.46 18.37 62.35 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.837 1.208 . . . . 0.0 114.899 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 59.95 -66.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.354 3.061 . . . . 0.0 115.85 -173.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.812 2.045 . . . . 0.0 113.915 -175.821 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 CA-C-O 119.716 -0.491 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.66 -12.11 18.41 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.844 3.029 . . . . 0.0 114.711 -175.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -72.63 164.61 54.69 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.573 1.082 . . . . 0.0 114.167 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 75.2 p -78.53 -15.26 58.78 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -73.82 109.5 7.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.729 2.012 . . . . 0.0 111.643 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 40.9 t30 -65.39 154.81 37.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.675 0.79 . . . . 0.0 112.12 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 54.6 t80 -63.58 -29.57 70.8 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 54.1 m -139.58 160.16 40.49 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.161 1.784 . . . . 0.0 112.252 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 5.3 p -75.27 -14.96 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.499 1.119 . . . . 0.0 113.881 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 57.9 17.52 4.36 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.508 2.723 . . . . 0.0 116.48 173.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 14.4 t -143.32 163.48 32.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.081 1.352 . . . . 0.0 112.542 176.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -99.26 -0.43 41.32 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.922 1.689 . . . . 0.0 112.41 166.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 10.6 tt0 61.44 20.31 11.05 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.086 2.155 . . . . 0.0 114.345 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 33.1 t -136.32 121.45 19.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.161 1.784 . . . . 0.0 111.345 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 65.9 p -131.41 9.23 4.7 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.935 1.694 . . . . 0.0 113.789 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.8 153.7 87.43 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.019 1.328 . . . . 0.0 113.06 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.57 -4.82 14.99 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 123.625 2.884 . . . . 0.0 114.263 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 78.1 mt -130.55 159.54 36.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.557 1.943 . . . . 0.0 111.674 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 62.0 p -143.18 179.44 7.06 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 112.898 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.91 -28.89 58.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.233 1.013 . . . . 0.0 113.078 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.14 -34.32 77.79 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.253 1.021 . . . . 0.0 113.064 177.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -68.88 -37.0 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.311 -0.868 . . . . 0.0 112.237 174.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -69.0 -43.77 74.16 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.206 1.003 . . . . 0.0 111.453 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -58.13 -44.99 88.08 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.745 1.218 . . . . 0.0 111.754 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 63.0 ttp -56.29 -53.42 57.47 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.409 1.084 . . . . 0.0 111.638 170.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.3 t80 -51.45 -59.07 4.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.82 0.848 . . . . 0.0 112.024 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -70.97 -20.14 62.47 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.05 -53.41 20.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.549 1.068 . . . . 0.0 111.309 167.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.1 mm -65.54 -31.47 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.809 0.844 . . . . 0.0 112.12 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -52.51 -41.52 63.51 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.642 1.577 . . . . 0.0 113.61 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.93 -20.26 63.61 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 92.5 mttt -70.29 -20.41 63.03 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.798 1.239 . . . . 0.0 112.92 174.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -115.94 -21.78 9.36 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.584 1.954 . . . . 0.0 113.38 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.9 t0 -123.57 70.26 45.68 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.767 2.027 . . . . 0.0 111.248 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.71 -19.32 27.84 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.081 2.521 . . . . 0.0 112.888 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -78.36 -7.66 57.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.276 1.43 . . . . 0.0 113.422 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.59 24.65 4.3 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.672 2.389 . . . . 0.0 115.413 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 59.0 p -69.74 -11.16 60.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.677 1.191 . . . . 0.0 113.903 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 76.98 14.78 1.97 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.431 2.693 . . . . 0.0 113.762 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -130.55 155.02 47.2 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.831 1.252 . . . . 0.0 112.488 173.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 29.1 pt -137.0 161.04 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.674 1.59 . . . . 0.0 111.184 166.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.57 149.78 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.133 0.973 . . . . 0.0 112.012 173.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 14.3 t80 -56.86 -34.07 67.46 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.396 -0.815 . . . . 0.0 112.827 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 19.5 m -64.86 -13.87 57.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.705 2.002 . . . . 0.0 114.703 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.0 m -120.77 -13.51 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 124.818 1.247 . . . . 0.0 113.723 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 5.4 tt -56.77 -41.05 76.95 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.142 1.377 . . . . 0.0 111.363 169.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 48.7 p -59.72 -38.05 80.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 173.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.79 -37.54 59.08 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.315 -0.866 . . . . 0.0 112.156 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.68 -44.28 96.68 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.628 171.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.99 62.97 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.177 1.391 . . . . 0.0 113.179 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -93.33 -4.02 52.38 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.272 1.829 . . . . 0.0 114.17 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -91.92 -20.06 21.81 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.334 -1.479 . . . . 0.0 113.177 -177.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.2 mt -75.67 173.11 11.5 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.602 1.961 . . . . 0.0 112.479 179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 5.9 t -100.7 164.21 11.97 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.621 0.768 . . . . 0.0 111.404 163.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -60.91 152.69 68.85 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.426 1.091 . . . . 0.0 111.828 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -85.46 -9.3 47.08 Favored 'Cis proline' 0 CA--C 1.546 1.086 0 N-CA-C 115.166 1.179 . . . . 0.0 115.166 -0.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.26 -31.33 72.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.713 1.142 . . . . 0.0 112.955 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -49.31 125.13 10.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.845 2.058 . . . . 0.0 112.591 172.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.2 mp -112.9 92.05 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.218 1.407 . . . . 0.0 107.973 166.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -56.73 130.56 46.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.378 1.071 . . . . 0.0 112.958 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.66 142.04 91.89 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 125.929 1.691 . . . . 0.0 112.49 -176.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.49 144.71 81.88 Favored 'Cis proline' 0 C--N 1.355 0.91 0 CA-C-N 119.931 1.011 . . . . 0.0 112.788 -5.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 26.8 p30 -132.36 4.87 4.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.184 1.393 . . . . 0.0 114.119 -174.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -55.4 -39.6 70.38 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.432 -1.417 . . . . 0.0 113.226 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 83.5 mt -67.75 -41.97 85.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.514 1.126 . . . . 0.0 110.867 175.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.6 m -58.11 -46.08 86.17 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.329 1.452 . . . . 0.0 111.724 176.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.83 -38.75 87.03 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.758 1.623 . . . . 0.0 112.954 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.6 -33.75 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.231 1.012 . . . . 0.0 111.205 173.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -79.87 -13.07 59.66 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 175.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 64.8 mtt -80.3 167.05 20.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.173 1.389 . . . . 0.0 111.685 168.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -104.18 51.71 0.77 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.932 1.693 . . . . 0.0 111.594 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 80.8 mt -75.53 119.65 78.05 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.161 1.384 . . . . 0.0 111.488 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.07 176.86 9.37 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.654 2.903 . . . . 0.0 111.894 173.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 63.8 mtt -134.38 116.61 15.39 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.844 0.858 . . . . 0.0 111.49 166.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 18.2 m -71.59 -28.7 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.116 1.366 . . . . 0.0 113.975 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 99.2 p -135.42 6.47 3.27 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.704 1.602 . . . . 0.0 114.044 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 103.93 -9.39 51.14 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.204 1.859 . . . . 0.0 115.204 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -141.04 -10.71 0.98 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -124.25 154.57 40.0 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.293 1.437 . . . . 0.0 113.184 -171.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.04 133.74 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 125.638 1.575 . . . . 0.0 110.186 -166.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -73.62 139.79 45.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.802 2.041 . . . . 0.0 114.087 -176.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -52.34 -49.52 64.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.873 1.669 . . . . 0.0 114.606 -175.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.97 -36.45 77.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.634 0.652 . . . . 0.0 111.761 -175.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.76 -33.59 76.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.816 0.846 . . . . 0.0 112.173 175.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.11 -47.12 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.001 0.92 . . . . 0.0 110.816 172.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 63.5 tp -54.87 -47.83 73.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.657 0.783 . . . . 0.0 111.594 173.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 77.3 t80 -54.1 -56.01 22.18 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.929 1.292 . . . . 0.0 111.481 172.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -55.96 -39.9 72.45 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -70.55 -44.86 66.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.689 0.796 . . . . 0.0 112.466 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 41.5 p -75.44 -27.09 58.82 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.152 0.981 . . . . 0.0 113.468 -178.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.86 -41.1 61.61 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.963 2.105 . . . . 0.0 112.81 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 26.2 mmt85 -58.76 -53.0 63.25 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.023 1.329 . . . . 0.0 112.266 170.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 13.2 t -60.01 -44.18 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 126.017 1.727 . . . . 0.0 111.841 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.7 mt -71.64 -12.13 61.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.112 1.765 . . . . 0.0 113.754 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 74.05 16.16 79.63 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.6 1.095 . . . . 0.0 114.232 -174.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -84.31 -4.33 58.8 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.185 1.794 . . . . 0.0 113.438 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.937 1.695 . . . . 0.0 113.073 172.596 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 CA-C-O 119.763 -0.465 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.37 154.93 13.65 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.053 3.168 . . . . 0.0 114.767 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.37 -57.44 4.43 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.648 1.594 . . . . 0.0 113.398 -177.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 29.3 m -62.12 -14.42 36.69 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.856 1.662 . . . . 0.0 114.552 178.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.28 -19.15 7.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.447 2.299 . . . . 0.0 114.293 171.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -58.36 -15.79 11.96 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 67.6 t80 -141.42 159.89 41.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.805 1.242 . . . . 0.0 112.4 172.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 40.7 m -74.32 51.73 0.45 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 127.568 2.347 . . . . 0.0 113.601 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 27.0 m -62.04 -16.92 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.878 1.671 . . . . 0.0 115.273 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -76.76 -14.01 59.97 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -173.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 26.4 m -144.21 97.94 3.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.494 1.518 . . . . 0.0 111.202 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -89.22 -14.62 35.55 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -136.13 4.38 2.96 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -167.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 52.0 m 47.53 66.42 1.03 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 126.187 1.795 . . . . 0.0 112.536 -176.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 40.5 p -76.57 22.13 0.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.388 2.275 . . . . 0.0 116.146 -164.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -57.07 148.87 48.66 Favored Pre-proline 0 CA--C 1.552 1.05 0 O-C-N 120.037 -1.664 . . . . 0.0 112.902 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -73.74 -25.48 14.59 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.125 2.55 . . . . 0.0 113.832 -176.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 82.6 mt -139.14 163.63 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.34 1.456 . . . . 0.0 112.356 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 70.1 m -134.97 168.49 19.01 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.123 2.169 . . . . 0.0 111.502 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.03 -36.03 67.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.887 1.275 . . . . 0.0 113.377 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.14 -28.21 69.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.668 1.587 . . . . 0.0 113.963 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -67.08 -43.49 82.48 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.299 -0.876 . . . . 0.0 111.711 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -66.56 -41.6 88.37 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.202 1.001 . . . . 0.0 112.129 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.7 t70 -62.33 -45.32 93.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.706 0.802 . . . . 0.0 111.689 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 14.2 tmm? -58.0 -42.1 84.44 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.024 1.33 . . . . 0.0 112.433 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -55.45 -57.05 13.47 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.943 0.792 . . . . 0.0 111.909 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -67.33 -29.42 68.98 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.63 -50.26 73.27 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.073 -1.017 . . . . 0.0 111.925 171.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.0 mm -73.5 -29.82 28.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.556 0.742 . . . . 0.0 112.492 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -53.86 -42.05 68.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.662 1.185 . . . . 0.0 112.667 176.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.45 -22.34 66.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.323 1.049 . . . . 0.0 113.113 -176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -70.61 -19.5 62.83 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.177 1.391 . . . . 0.0 113.014 177.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -117.16 -21.39 8.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.642 1.977 . . . . 0.0 113.112 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 28.4 t0 -125.96 71.57 68.89 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 127.139 2.176 . . . . 0.0 110.629 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.66 -19.02 28.39 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.867 2.378 . . . . 0.0 112.753 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.35 -10.36 59.34 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.476 1.51 . . . . 0.0 113.169 172.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 56.45 22.56 6.6 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.41 2.284 . . . . 0.0 115.443 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.4 p -69.3 -10.6 58.6 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.103 1.361 . . . . 0.0 114.501 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 73.48 23.25 2.51 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.759 2.424 . . . . 0.0 113.935 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -134.39 150.74 50.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.034 0.933 . . . . 0.0 112.808 170.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.76 162.1 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 125.338 1.455 . . . . 0.0 111.661 168.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -78.59 151.39 32.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.303 1.041 . . . . 0.0 112.212 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 13.1 t80 -60.06 -30.83 69.46 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.186 -0.946 . . . . 0.0 112.73 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 20.8 m -62.73 -17.54 61.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.433 1.893 . . . . 0.0 114.615 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.7 m -118.49 -10.3 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.676 1.19 . . . . 0.0 113.817 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.92 -41.18 95.65 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.135 0.879 . . . . 0.0 111.1 173.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 50.5 p -63.29 -30.52 71.65 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 173.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.39 -37.16 37.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.44 0.696 . . . . 0.0 112.625 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 34.4 t80 -59.8 -49.87 76.01 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.606 1.562 . . . . 0.0 111.634 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -51.06 -41.88 60.2 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.05 1.74 . . . . 0.0 113.202 176.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.53 -24.35 58.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.105 1.362 . . . . 0.0 114.016 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.33 -10.06 48.13 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.6 170.91 15.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.492 1.517 . . . . 0.0 111.454 177.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 75.2 m -88.09 160.62 17.73 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.834 0.826 . . . . 0.0 111.158 165.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.75 153.31 88.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 O-C-N 121.121 -0.987 . . . . 0.0 110.787 167.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -81.63 -11.76 40.29 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 N-CA-C 115.29 1.227 . . . . 0.0 115.29 -0.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 68.7 mt -70.55 -30.63 67.4 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.78 165.13 5.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.4 mp -137.12 99.08 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 127.269 2.228 . . . . 0.0 108.248 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.04 141.88 58.61 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.396 0.678 . . . . 0.0 112.355 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 93.0 mttt -60.28 150.37 72.38 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.436 1.094 . . . . 0.0 113.057 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.24 128.78 14.68 Favored 'Cis proline' 0 CA--C 1.542 0.892 0 CA-C-N 118.79 0.604 . . . . 0.0 111.299 -10.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 46.4 p30 -120.69 -5.17 9.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -55.93 -41.62 74.87 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.551 1.069 . . . . 0.0 113.218 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 72.4 mt -64.17 -44.73 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.804 1.242 . . . . 0.0 110.538 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -50.29 74.09 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.075 0.95 . . . . 0.0 111.157 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.79 -41.02 97.2 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.309 1.444 . . . . 0.0 112.93 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.9 mt -59.87 -38.38 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.744 1.218 . . . . 0.0 111.469 173.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -74.57 -11.16 60.13 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.968 1.469 . . . . 0.0 114.968 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 52.9 mtt -77.49 169.6 18.03 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.089 1.313 . . . . 0.0 112.104 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.1 t70 -83.12 7.36 16.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.11 1.764 . . . . 0.0 113.752 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 85.2 mt -48.61 116.36 5.12 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 126.541 1.936 . . . . 0.0 113.075 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -76.89 179.66 6.28 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 124.142 3.228 . . . . 0.0 112.591 177.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 66.7 mtt -135.04 134.04 40.0 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.417 1.487 . . . . 0.0 110.404 162.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 26.1 m -84.97 -19.37 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.939 1.295 . . . . 0.0 113.684 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.3 p -130.14 -9.44 4.29 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.502 1.921 . . . . 0.0 114.066 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 87.39 -0.1 85.1 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.732 1.158 . . . . 0.0 114.675 -162.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.4 p30 -146.58 -14.03 0.44 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -120.04 156.79 30.24 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.826 1.65 . . . . 0.0 112.847 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 4.1 mp -139.35 134.03 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.087 1.755 . . . . 0.0 110.328 -167.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -75.85 139.41 41.69 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.673 1.589 . . . . 0.0 113.277 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 44.2 t -47.21 -59.0 3.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.968 2.507 . . . . 0.0 114.072 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.8 -35.65 81.79 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.66 -0.65 . . . . 0.0 112.299 -172.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -66.19 -33.54 75.98 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.367 -0.833 . . . . 0.0 112.421 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 48.8 mt -68.4 -47.76 76.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.345 1.058 . . . . 0.0 110.612 172.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 66.3 tp -52.87 -51.8 59.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.243 1.017 . . . . 0.0 111.473 172.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 35.9 t80 -53.52 -52.35 59.91 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.35 1.86 . . . . 0.0 111.829 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.19 -44.32 88.01 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.626 -0.672 . . . . 0.0 112.669 176.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -70.53 -37.19 74.06 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 63.1 p -71.69 -38.63 70.56 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.929 1.24 . . . . 0.0 112.863 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 12.6 mptt -52.59 -40.08 62.28 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.554 1.142 . . . . 0.0 113.864 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -46.77 -62.11 1.54 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.002 1.721 . . . . 0.0 112.002 169.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 1.8 t -64.22 -39.37 85.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 126.101 1.761 . . . . 0.0 112.165 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.94 -18.1 64.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.569 1.548 . . . . 0.0 113.733 177.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 142.99 -1.12 1.44 Allowed Glycine 0 CA--C 1.534 1.273 0 N-CA-C 116.596 1.398 . . . . 0.0 116.596 167.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -71.62 -21.45 61.84 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.008 1.904 . . . . 0.0 114.014 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.088 1.355 . . . . 0.0 112.645 170.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.452 0 CA-C-O 119.622 -0.543 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.92 -19.88 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.142 3.228 . . . . 0.0 114.1 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 81.15 1.6 90.07 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.999 1.285 . . . . 0.0 115.624 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 43.2 m -128.96 9.22 5.76 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.029 1.732 . . . . 0.0 114.109 -174.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -143.32 172.71 12.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.569 1.948 . . . . 0.0 111.646 -174.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 58.9 t30 -74.3 61.06 0.86 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.492 1.517 . . . . 0.0 112.983 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 66.0 t80 -67.58 -17.23 64.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.62 1.568 . . . . 0.0 113.486 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 22.7 m -62.4 -12.3 20.73 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.932 1.693 . . . . 0.0 115.347 -175.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 33.7 m -60.1 -16.76 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.52 1.528 . . . . 0.0 114.09 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -71.02 -10.63 60.08 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.946 1.698 . . . . 0.0 114.623 169.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 42.8 m -130.27 -41.66 1.24 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.263 1.825 . . . . 0.0 112.211 -175.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.78 154.0 38.26 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.467 1.507 . . . . 0.0 112.884 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.22 112.26 1.85 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.885 1.274 . . . . 0.0 111.884 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 6.7 t -128.21 9.36 6.18 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.952 1.701 . . . . 0.0 113.226 -173.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 36.0 p -128.38 159.43 35.38 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.245 1.818 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -141.58 159.98 58.3 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.313 1.845 . . . . 0.0 111.557 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.4 -9.31 20.17 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.139 2.559 . . . . 0.0 113.983 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 72.0 mt -132.01 158.66 40.93 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.333 2.253 . . . . 0.0 110.319 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 13.6 t -140.31 172.36 12.85 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.402 1.481 . . . . 0.0 111.53 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -59.85 -23.19 63.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.438 1.095 . . . . 0.0 112.908 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.74 -38.1 89.2 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.082 0.953 . . . . 0.0 112.891 172.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -69.51 -38.17 77.48 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.355 0.662 . . . . 0.0 111.592 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.89 -41.83 70.78 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.715 0.806 . . . . 0.0 111.884 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.69 -44.58 90.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.257 1.023 . . . . 0.0 112.111 171.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 60.7 ttp -55.28 -51.4 66.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.017 0.927 . . . . 0.0 111.364 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 38.3 t80 -53.46 -54.42 37.28 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.687 0.795 . . . . 0.0 111.341 178.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -66.55 -31.03 71.49 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -65.66 -51.18 61.53 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 173.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.41 -35.37 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.2 1.0 . . . . 0.0 111.945 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 62.8 t-105 -52.64 -43.38 65.43 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.659 1.584 . . . . 0.0 113.416 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -58.35 -26.36 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.926 1.29 . . . . 0.0 113.678 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.33 -19.13 64.64 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.384 1.474 . . . . 0.0 113.432 175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -118.37 -16.85 9.56 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.53 1.932 . . . . 0.0 113.132 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 34.9 t0 -120.35 66.29 12.08 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 126.127 1.771 . . . . 0.0 110.846 171.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -68.48 -17.81 43.62 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.968 2.446 . . . . 0.0 112.299 173.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.18 -12.77 61.33 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.014 1.726 . . . . 0.0 113.199 171.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.09 18.53 1.77 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.948 2.499 . . . . 0.0 115.609 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 67.9 p -69.45 -13.39 62.33 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.01 1.324 . . . . 0.0 114.557 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 65.83 25.35 11.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.233 1.813 . . . . 0.0 113.374 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -130.28 155.36 46.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.096 1.358 . . . . 0.0 111.295 164.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 36.9 pt -135.09 163.28 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 125.344 1.457 . . . . 0.0 111.404 167.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -84.87 148.67 26.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.859 1.264 . . . . 0.0 111.509 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 11.4 t80 -59.25 -31.45 69.09 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 121.334 -0.854 . . . . 0.0 113.297 -178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 60.7 p -63.67 -16.08 60.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.708 2.003 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 35.2 m -119.36 -13.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.886 1.274 . . . . 0.0 113.657 174.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.99 -42.83 80.95 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.655 1.182 . . . . 0.0 111.105 171.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 63.1 p -63.33 -28.24 69.87 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 175.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -83.5 -37.05 23.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.85 0.86 . . . . 0.0 112.376 173.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 40.7 t80 -58.92 -47.53 84.71 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.417 1.487 . . . . 0.0 111.864 169.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -55.34 -29.98 59.41 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.642 1.577 . . . . 0.0 113.041 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -94.84 -4.98 46.11 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.847 1.659 . . . . 0.0 114.408 177.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -90.98 -15.6 29.4 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.619 -1.301 . . . . 0.0 113.354 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 11.2 mt -76.8 174.5 10.44 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.295 2.238 . . . . 0.0 112.261 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 6.2 t -106.76 163.9 12.54 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.112 0.965 . . . . 0.0 110.939 164.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.51 150.84 84.83 Favored Pre-proline 0 CA--C 1.554 1.128 0 O-C-N 121.136 -0.977 . . . . 0.0 111.7 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -83.45 -11.21 42.92 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 N-CA-C 114.965 1.102 . . . . 0.0 114.965 0.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.3 mt -68.48 -25.84 65.17 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.815 1.189 . . . . 0.0 113.318 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -52.01 138.06 25.8 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.17 2.188 . . . . 0.0 113.023 168.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.48 93.04 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.344 1.857 . . . . 0.0 107.613 163.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.42 141.75 58.2 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.757 0.823 . . . . 0.0 112.905 -175.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.09 155.6 78.04 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 124.3 1.04 . . . . 0.0 113.043 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -60.75 131.12 7.39 Favored 'Cis proline' 0 C--N 1.354 0.85 0 CA-C-N 118.624 0.544 . . . . 0.0 112.281 -17.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 48.4 p30 -125.1 0.37 7.86 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -173.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -57.13 -42.79 81.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.806 1.184 . . . . 0.0 112.76 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 91.8 mt -66.75 -46.2 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.957 1.303 . . . . 0.0 109.764 177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 37.9 m -55.54 -44.21 76.51 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.815 1.646 . . . . 0.0 112.479 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.62 -39.53 67.17 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.424 1.49 . . . . 0.0 112.783 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.67 -35.02 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.192 0.997 . . . . 0.0 111.613 173.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.68 -11.1 60.66 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 176.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 60.3 mtt -81.05 170.07 16.67 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.976 1.262 . . . . 0.0 112.733 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.97 9.93 11.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.552 1.941 . . . . 0.0 114.006 176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 87.9 mt -48.64 119.07 7.66 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 126.471 1.908 . . . . 0.0 112.951 -176.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -77.06 179.99 5.99 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.379 3.386 . . . . 0.0 112.18 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 62.3 mtt -136.7 104.94 5.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.537 1.535 . . . . 0.0 110.426 164.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 34.6 m -69.11 -25.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.036 1.334 . . . . 0.0 114.421 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 49.6 m -131.9 4.83 4.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.678 1.591 . . . . 0.0 113.479 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 93.69 -10.84 72.14 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.082 1.801 . . . . 0.0 114.841 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -142.23 -17.44 0.73 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 175.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -110.36 155.82 21.62 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.21 1.404 . . . . 0.0 113.331 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.7 mp -140.42 135.18 35.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 126.68 1.992 . . . . 0.0 109.189 -170.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -76.26 139.6 41.2 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.187 1.795 . . . . 0.0 114.492 -174.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 49.9 t -46.51 -58.66 3.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.283 2.233 . . . . 0.0 113.636 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -64.2 -34.34 77.87 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.602 0.594 . . . . 0.0 112.602 -176.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 -35.89 71.79 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.328 0.651 . . . . 0.0 111.878 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.73 -48.32 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 124.357 1.063 . . . . 0.0 110.176 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 61.1 tp -54.69 -52.91 60.92 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.837 0.455 . . . . 0.0 111.063 174.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 24.6 t80 -55.54 -46.48 77.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.972 1.309 . . . . 0.0 112.961 177.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.6 84.7 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.862 -1.148 . . . . 0.0 112.699 173.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -73.56 -32.91 64.42 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.182 0.993 . . . . 0.0 112.855 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 77.6 p -83.4 -33.56 25.72 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.755 1.161 . . . . 0.0 113.83 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -48.97 -48.67 42.97 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 120.48 1.491 . . . . 0.0 113.503 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -63.24 -26.48 68.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.73 1.612 . . . . 0.0 114.708 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 22.1 t -83.46 -43.7 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.548 1.539 . . . . 0.0 111.104 175.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.95 -18.95 64.91 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.665 1.986 . . . . 0.0 113.263 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.42 22.41 56.59 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.951 1.263 . . . . 0.0 114.235 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -68.31 122.87 19.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.663 1.185 . . . . 0.0 111.679 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.255 1.368 0 C-N-CA 126.287 1.835 . . . . 0.0 112.186 -178.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 CA-C-O 119.521 -0.599 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.07 168.71 1.75 Allowed 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.85 3.7 . . . . 0.0 114.912 176.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 80.19 27.98 50.67 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.473 1.035 . . . . 0.0 114.697 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.4 m -56.89 -23.15 42.62 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.27 1.828 . . . . 0.0 115.657 -174.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -142.03 -50.74 0.39 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.036 1.335 . . . . 0.0 111.553 170.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -114.33 118.42 33.84 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.19 1.796 . . . . 0.0 109.976 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -65.04 -20.99 66.76 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.761 1.224 . . . . 0.0 114.156 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 62.6 m -80.05 57.21 2.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.28 1.432 . . . . 0.0 111.791 176.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 26.9 m -61.95 -15.98 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -78.69 -2.19 38.06 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.204 1.802 . . . . 0.0 114.836 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 6.1 t -62.68 156.54 23.25 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.296 1.438 . . . . 0.0 113.332 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 157.63 22.63 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.248 1.419 . . . . 0.0 112.802 -177.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -71.84 -16.38 62.16 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.746 1.619 . . . . 0.0 114.7 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 53.0 m -58.65 113.66 2.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.045 2.138 . . . . 0.0 113.696 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 61.1 p -139.18 172.97 12.06 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.542 2.337 . . . . 0.0 109.221 172.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -62.75 154.92 73.03 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.423 1.089 . . . . 0.0 112.951 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.71 -6.39 17.52 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.452 2.768 . . . . 0.0 114.328 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 54.4 mt -131.33 154.2 48.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.656 1.982 . . . . 0.0 111.047 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.8 t -143.89 178.46 7.83 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 111.767 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -56.09 -34.51 66.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.11 1.364 . . . . 0.0 112.764 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -59.12 -36.28 74.92 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.125 1.37 . . . . 0.0 113.469 176.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -68.23 -43.6 77.6 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.113 0.965 . . . . 0.0 111.612 177.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -69.19 -39.47 78.67 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.895 0.878 . . . . 0.0 111.841 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.67 -47.51 84.23 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.281 1.032 . . . . 0.0 111.797 171.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.1 tmm? -57.93 -45.21 86.92 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.567 1.147 . . . . 0.0 112.134 172.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.86 -57.18 12.63 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.843 0.747 . . . . 0.0 111.817 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -71.13 -24.58 62.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.18 -52.17 63.43 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.536 -1.353 . . . . 0.0 111.433 169.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.56 -34.39 69.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 0.0 112.105 176.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -52.64 -47.63 66.94 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.625 1.57 . . . . 0.0 113.723 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.15 -15.89 60.73 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 91.1 mttt -67.46 -25.84 66.09 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.28 1.032 . . . . 0.0 112.556 170.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.68 -17.74 14.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.747 2.019 . . . . 0.0 112.94 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 39.2 t0 -122.69 71.66 39.92 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.926 2.09 . . . . 0.0 111.348 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.62 -17.37 29.86 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.81 2.34 . . . . 0.0 112.9 174.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -79.08 -13.32 59.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.486 1.514 . . . . 0.0 113.062 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 53.79 27.32 6.92 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.858 1.663 . . . . 0.0 113.356 -168.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.9 t -73.36 -14.51 61.3 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.415 1.486 . . . . 0.0 113.219 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 65.42 22.18 11.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.177 2.191 . . . . 0.0 114.136 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -128.63 149.99 50.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.481 1.912 . . . . 0.0 111.087 171.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 39.2 pt -135.34 161.35 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 125.075 1.35 . . . . 0.0 111.08 165.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -76.09 148.0 38.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.076 0.95 . . . . 0.0 111.624 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 7.9 t80 -60.48 -26.83 67.09 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.179 -0.95 . . . . 0.0 112.069 172.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 16.3 m -64.58 -16.87 63.36 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.697 1.999 . . . . 0.0 115.195 173.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 26.8 m -119.79 -9.78 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 124.69 1.196 . . . . 0.0 113.648 174.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 51.9 tp -53.12 -40.34 64.11 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.937 1.295 . . . . 0.0 112.564 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 35.7 p -63.93 -31.89 73.23 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.429 1.492 . . . . 0.0 114.239 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -80.68 -38.99 27.97 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.614 -0.679 . . . . 0.0 112.234 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.11 -47.52 84.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.391 169.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.44 -29.95 51.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.33 1.452 . . . . 0.0 113.398 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 31.2 t70 -94.62 -8.11 38.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.402 1.481 . . . . 0.0 114.454 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -89.34 -18.66 26.47 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.465 -1.397 . . . . 0.0 113.164 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 8.8 mt -72.6 164.97 25.61 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.522 1.929 . . . . 0.0 112.583 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 43.7 m -84.27 159.59 20.92 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.208 1.003 . . . . 0.0 111.058 162.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -61.78 151.52 78.88 Favored Pre-proline 0 CA--C 1.552 1.049 0 O-C-N 120.948 -1.095 . . . . 0.0 110.726 168.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -82.88 -9.01 46.19 Favored 'Cis proline' 0 CA--C 1.548 1.182 0 N-CA-C 115.016 1.121 . . . . 0.0 115.016 -0.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 37.8 mt -68.94 -25.56 64.63 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.108 0.867 . . . . 0.0 113.176 -176.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -50.38 130.07 22.8 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.776 2.43 . . . . 0.0 112.903 170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.04 95.11 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.857 1.663 . . . . 0.0 107.577 164.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -61.24 138.95 58.22 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.938 0.895 . . . . 0.0 112.776 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 88.5 mttt -61.09 152.27 72.01 Favored Pre-proline 0 N--CA 1.478 0.934 0 C-N-CA 124.769 1.227 . . . . 0.0 113.399 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.21 130.13 16.52 Favored 'Cis proline' 0 CA--C 1.544 1.007 0 CA-C-N 118.667 0.559 . . . . 0.0 111.532 -10.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 41.5 p30 -123.14 0.07 8.97 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -57.81 -40.65 80.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.093 1.315 . . . . 0.0 112.666 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.9 mm -67.98 -42.53 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.35 1.06 . . . . 0.0 110.866 175.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 16.3 m -57.85 -40.77 80.91 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.468 1.507 . . . . 0.0 112.594 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.13 -46.7 67.01 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.738 1.615 . . . . 0.0 111.904 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 49.2 mt -56.36 -33.54 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.267 1.027 . . . . 0.0 112.045 177.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -75.88 -7.55 54.8 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 62.6 mtt -80.32 172.3 13.95 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.038 1.29 . . . . 0.0 112.568 173.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 23.9 t70 -84.82 13.85 5.42 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.567 1.947 . . . . 0.0 113.485 172.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 38.9 mt -48.78 121.28 9.96 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.297 1.839 . . . . 0.0 113.405 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -76.48 179.38 6.46 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.792 2.995 . . . . 0.0 111.658 171.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 57.3 mtt -136.52 111.2 8.68 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.051 1.34 . . . . 0.0 109.849 167.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 19.8 m -67.03 -26.95 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -174.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 53.4 m -133.23 4.78 3.76 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.292 1.837 . . . . 0.0 113.782 -178.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 92.43 -4.22 76.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.066 1.793 . . . . 0.0 114.698 -174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -148.98 -2.84 0.45 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -133.64 160.08 38.58 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.406 1.882 . . . . 0.0 111.73 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.84 145.67 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.494 1.518 . . . . 0.0 110.835 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -80.44 145.3 32.01 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.919 2.088 . . . . 0.0 112.346 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.0 p -53.74 -48.22 69.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 12.1 tpt -68.81 -33.06 73.21 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.411 -0.806 . . . . 0.0 112.228 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.27 -34.41 65.78 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.657 0.783 . . . . 0.0 111.478 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 75.0 mt -62.44 -52.93 53.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.006 0.923 . . . . 0.0 110.38 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.0 tp -55.04 -46.32 75.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.905 0.882 . . . . 0.0 111.941 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 80.1 t80 -54.87 -53.58 53.57 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.689 1.196 . . . . 0.0 112.321 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.73 78.61 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.11 -52.55 18.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.83 1.252 . . . . 0.0 111.264 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 47.4 p -64.52 -21.23 66.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.498 1.119 . . . . 0.0 113.924 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 13.7 tptm -48.74 -49.07 39.93 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.842 1.657 . . . . 0.0 113.027 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -70.67 -36.07 73.17 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.567 1.947 . . . . 0.0 113.124 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 21.1 t -65.72 -44.67 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.092 1.357 . . . . 0.0 110.823 176.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 76.6 mt -72.72 -16.07 61.67 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.903 1.681 . . . . 0.0 113.741 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 78.1 18.87 75.89 Favored Glycine 0 CA--C 1.541 1.682 0 C-N-CA 124.515 1.055 . . . . 0.0 114.064 -177.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -91.52 -0.11 57.57 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.078 1.751 . . . . 0.0 113.751 -173.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.256 1.419 0 C-N-CA 125.349 1.46 . . . . 0.0 113.299 178.152 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 CA-C-O 119.573 -0.57 . . . . 0.0 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.51 169.9 1.49 Allowed 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 124.696 3.597 . . . . 0.0 115.3 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 87.89 -174.58 44.39 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.119 1.342 . . . . 0.0 113.806 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 8.5 t -140.27 169.21 18.09 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.549 1.539 . . . . 0.0 111.865 178.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -75.85 172.32 12.9 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.096 1.759 . . . . 0.0 112.85 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 29.5 t30 -54.38 -31.17 54.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.087 1.755 . . . . 0.0 114.358 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -75.9 -9.48 58.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.378 1.471 . . . . 0.0 114.504 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 77.4 p 35.05 65.65 0.36 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.623 2.769 . . . . 0.0 114.966 174.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.3 m -69.64 -7.9 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -173.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -64.81 168.07 6.72 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.952 1.701 . . . . 0.0 113.909 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 11.2 m -73.68 76.62 1.53 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.267 1.827 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -73.44 -23.02 60.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.776 1.63 . . . . 0.0 113.856 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.24 154.1 46.23 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.911 1.684 . . . . 0.0 111.802 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 70.5 m -140.45 172.84 12.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.65 1.58 . . . . 0.0 112.866 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 38.8 p -111.9 29.35 7.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.479 2.311 . . . . 0.0 112.977 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -54.54 146.55 33.73 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.205 1.802 . . . . 0.0 113.884 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -79.53 -4.32 13.51 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.816 3.011 . . . . 0.0 115.023 -173.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 59.5 mt -124.6 155.77 38.55 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.83 1.652 . . . . 0.0 111.695 -176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 8.4 t -142.56 176.15 9.24 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.99 1.716 . . . . 0.0 111.907 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -55.0 -35.42 64.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.238 1.415 . . . . 0.0 113.286 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -62.31 -31.32 71.91 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -69.65 -43.91 71.65 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.772 0.829 . . . . 0.0 111.585 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -68.6 -41.28 79.8 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.245 1.018 . . . . 0.0 111.73 175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.6 -43.92 93.57 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.637 0.775 . . . . 0.0 112.305 172.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 13.7 tmm? -59.27 -46.17 89.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.494 1.118 . . . . 0.0 111.998 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 42.7 t80 -55.21 -52.75 62.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.612 -0.68 . . . . 0.0 112.037 174.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -61.93 -41.63 98.17 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -59.7 -45.39 92.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.217 1.007 . . . . 0.0 112.408 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 49.4 mm -74.68 -33.35 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.914 0.885 . . . . 0.0 111.64 177.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -54.89 -45.07 74.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.933 -1.104 . . . . 0.0 113.008 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.3 -21.54 59.86 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -71.86 -21.68 61.63 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.431 1.092 . . . . 0.0 112.896 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -113.95 -18.26 11.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.303 1.841 . . . . 0.0 113.136 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -122.23 72.49 36.73 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 126.474 1.91 . . . . 0.0 110.888 171.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.3 -17.05 31.23 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.063 2.509 . . . . 0.0 112.725 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.92 -13.43 60.54 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.562 1.545 . . . . 0.0 113.028 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 52.1 24.94 2.94 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.677 1.991 . . . . 0.0 113.873 -168.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 3.7 t -69.84 -11.25 60.72 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.144 1.377 . . . . 0.0 113.792 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 73.18 15.69 4.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.443 2.297 . . . . 0.0 113.556 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -132.34 149.59 52.33 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.739 1.616 . . . . 0.0 110.918 175.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 40.6 pt -134.06 166.05 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.059 1.344 . . . . 0.0 111.014 165.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -85.67 152.19 23.29 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.53 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 9.0 t80 -59.39 -31.68 69.46 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.19 -0.944 . . . . 0.0 112.536 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 17.3 m -63.09 -15.49 56.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.635 1.974 . . . . 0.0 114.696 175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 34.2 m -123.62 -8.35 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 124.952 1.301 . . . . 0.0 113.729 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.07 -37.45 77.11 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.523 1.056 . . . . 0.0 111.435 170.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 34.1 p -67.98 -30.67 70.0 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.687 1.195 . . . . 0.0 113.05 177.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -74.39 -45.99 43.25 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.011 0.925 . . . . 0.0 111.851 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.25 -49.63 73.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.713 1.205 . . . . 0.0 112.183 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.48 -29.29 49.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.841 1.657 . . . . 0.0 113.584 176.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.6 t70 -98.37 -3.29 37.31 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.705 1.602 . . . . 0.0 114.287 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -92.33 -18.46 23.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.62 -1.3 . . . . 0.0 113.099 177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.73 164.31 26.82 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.497 1.919 . . . . 0.0 112.682 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 49.1 m -85.9 159.17 19.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.131 0.973 . . . . 0.0 110.66 163.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.73 152.43 68.07 Favored Pre-proline 0 CA--C 1.552 1.037 0 O-C-N 121.088 -1.007 . . . . 0.0 111.009 168.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -83.97 -8.31 48.37 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 115.172 1.181 . . . . 0.0 115.172 -0.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 52.7 mt -69.82 -24.85 63.53 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -50.84 132.28 26.63 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.806 2.442 . . . . 0.0 113.441 171.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 3.8 mp -119.4 93.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.956 1.702 . . . . 0.0 107.531 163.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -62.21 140.95 58.44 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.626 0.77 . . . . 0.0 112.367 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 95.1 mttt -63.54 152.78 84.95 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 123.909 0.884 . . . . 0.0 113.137 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.77 126.58 10.5 Favored 'Cis proline' 0 CA--C 1.541 0.868 0 CA-C-N 119.104 0.716 . . . . 0.0 111.328 -7.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 53.2 p30 -119.26 -4.28 10.49 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -52.95 -51.61 60.86 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.798 1.239 . . . . 0.0 113.156 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.87 -29.87 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.937 0.895 . . . . 0.0 110.568 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 4.7 t -72.87 -39.44 66.47 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.194 0.998 . . . . 0.0 111.981 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.08 -41.04 95.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.878 1.271 . . . . 0.0 112.106 169.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.94 -32.68 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.712 0.805 . . . . 0.0 111.737 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -73.3 -11.35 60.47 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 172.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 65.9 mtt -80.69 170.92 15.68 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.42 1.464 . . . . 0.0 112.124 171.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.62 17.66 11.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.235 1.814 . . . . 0.0 112.868 178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 72.6 mt -50.78 122.02 15.9 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.332 1.853 . . . . 0.0 113.124 -175.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -76.11 174.62 12.53 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.524 2.816 . . . . 0.0 111.866 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.7 mtt -133.62 109.63 9.34 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.242 1.417 . . . . 0.0 109.553 166.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 15.9 m -72.41 -17.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -164.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 23.3 t -143.01 -42.13 0.31 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.61 1.564 . . . . 0.0 113.04 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . -176.92 -36.84 0.05 OUTLIER Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.016 0.817 . . . . 0.0 114.854 172.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -138.99 5.43 2.34 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.041 1.337 . . . . 0.0 113.976 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -123.11 148.83 45.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.28 1.432 . . . . 0.0 112.832 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.39 133.29 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.173 1.389 . . . . 0.0 110.437 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -75.6 142.55 42.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.881 2.072 . . . . 0.0 113.959 -176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.9 p -53.72 -49.63 67.69 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.411 1.484 . . . . 0.0 114.472 -176.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 73.9 mmm -68.71 -31.37 70.39 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.39 -35.5 68.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 118.543 0.611 . . . . 0.0 111.662 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.27 -51.38 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.809 0.844 . . . . 0.0 110.301 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.36 -46.4 72.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.476 1.11 . . . . 0.0 112.332 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.31 -51.03 71.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.826 1.251 . . . . 0.0 112.237 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -57.18 -40.98 78.43 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.048 0.939 . . . . 0.0 112.932 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -68.65 -53.81 20.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.741 0.816 . . . . 0.0 111.794 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 37.0 p -64.95 -30.01 70.97 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -175.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -51.72 -44.71 63.32 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.356 1.062 . . . . 0.0 112.461 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.19 -38.52 91.48 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.199 1.0 . . . . 0.0 112.658 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 6.5 t -65.71 -42.54 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.707 1.203 . . . . 0.0 111.152 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.45 -9.39 58.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.457 1.903 . . . . 0.0 114.175 176.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 83.86 13.32 75.32 Favored Glycine 0 CA--C 1.541 1.685 0 C-N-CA 124.939 1.257 . . . . 0.0 114.732 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.01 12.85 8.57 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.712 2.005 . . . . 0.0 113.519 -177.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 127.849 2.46 . . . . 0.0 114.073 176.629 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 CA-C-O 119.34 -0.7 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -72.92 -20.08 22.64 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.181 2.588 . . . . 0.0 114.343 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 76.4 -1.91 59.35 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.214 1.388 . . . . 0.0 115.557 178.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 16.8 p -64.19 -57.86 8.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.114 1.766 . . . . 0.0 112.196 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.93 -1.28 3.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.456 1.903 . . . . 0.0 113.75 177.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -73.58 -14.24 61.16 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 125.619 1.568 . . . . 0.0 114.552 -173.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.91 173.47 11.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.082 1.753 . . . . 0.0 112.097 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 83.9 p -143.63 177.54 8.42 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.96 1.704 . . . . 0.0 111.355 168.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 35.2 m -72.28 -13.85 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . -88.13 143.33 27.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.231 1.412 . . . . 0.0 112.675 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 13.6 m -68.14 147.43 52.31 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.693 1.197 . . . . 0.0 110.364 169.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.63 164.89 13.43 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.691 0.758 . . . . 0.0 112.708 175.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -137.76 167.65 21.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.696 1.598 . . . . 0.0 111.688 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 7.8 t -124.58 177.64 5.84 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.908 1.683 . . . . 0.0 112.166 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 43.9 p -76.06 -1.87 28.02 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.6 133.36 92.69 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.892 1.677 . . . . 0.0 112.505 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.14 -8.94 16.57 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.056 3.171 . . . . 0.0 114.254 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 87.1 mt -114.05 157.37 22.62 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.36 1.864 . . . . 0.0 111.463 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 69.4 m -136.07 169.42 17.64 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.003 2.121 . . . . 0.0 111.587 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -53.24 -36.6 61.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.374 1.47 . . . . 0.0 113.193 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.98 -29.62 69.79 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.236 1.414 . . . . 0.0 113.78 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -70.14 -40.23 74.9 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.006 -1.058 . . . . 0.0 111.898 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -65.28 -46.77 79.12 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.088 0.955 . . . . 0.0 111.071 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.44 -44.31 84.61 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.772 0.829 . . . . 0.0 112.322 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 12.5 tmm? -60.49 -43.88 96.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.987 1.315 . . . . 0.0 112.313 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 24.4 t80 -55.53 -53.83 51.55 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.982 0.81 . . . . 0.0 111.691 172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -63.62 -34.36 77.66 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.02 -51.09 63.53 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.139 -0.975 . . . . 0.0 111.698 173.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 46.4 mm -68.51 -30.54 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.711 0.805 . . . . 0.0 111.777 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -53.69 -42.24 67.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.705 1.202 . . . . 0.0 113.577 175.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 32.9 tp10 -59.19 -26.17 64.58 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.517 1.527 . . . . 0.0 113.309 -178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -70.92 -24.62 62.49 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.57 1.548 . . . . 0.0 112.723 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -111.11 -19.95 12.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.845 2.058 . . . . 0.0 113.475 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 52.8 t0 -118.38 74.4 11.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.478 1.911 . . . . 0.0 110.935 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.36 -17.06 27.57 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.16 2.573 . . . . 0.0 112.994 174.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.15 -14.07 60.91 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.924 1.289 . . . . 0.0 113.005 173.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 50.24 26.91 2.39 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.137 1.775 . . . . 0.0 113.375 -164.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 4.6 t -73.41 -11.0 60.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.248 1.419 . . . . 0.0 113.939 -172.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 75.0 15.83 2.96 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.655 2.382 . . . . 0.0 113.604 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -133.3 154.24 50.88 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.493 1.917 . . . . 0.0 111.525 175.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 43.5 pt -133.96 163.41 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 125.407 1.483 . . . . 0.0 111.369 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -79.12 150.53 31.74 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.487 1.115 . . . . 0.0 112.029 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.92 -26.38 68.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.082 -1.011 . . . . 0.0 112.408 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 78.6 p -67.44 -15.99 63.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.028 1.731 . . . . 0.0 114.719 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 23.5 m -118.82 -13.47 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.952 1.301 . . . . 0.0 113.842 175.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 8.3 tt -57.98 -38.35 75.92 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.918 0.781 . . . . 0.0 112.319 177.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 59.5 p -65.47 -21.0 66.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.01 -34.4 14.45 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.202 1.001 . . . . 0.0 112.169 171.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.77 -46.62 87.1 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.536 1.134 . . . . 0.0 112.001 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -54.03 -29.71 44.78 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.16 1.384 . . . . 0.0 113.248 173.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -99.53 2.86 45.2 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.834 2.054 . . . . 0.0 114.117 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -100.22 -21.22 15.58 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 112.824 177.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 10.4 mt -66.56 161.55 22.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.991 1.717 . . . . 0.0 112.368 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 72.1 m -83.91 158.2 21.68 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.662 0.744 . . . . 0.0 111.011 164.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.86 150.68 76.29 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 121.212 -0.93 . . . . 0.0 110.826 169.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.23 -11.67 42.03 Favored 'Cis proline' 0 CA--C 1.543 0.973 0 N-CA-C 115.258 1.214 . . . . 0.0 115.258 0.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.99 -27.98 69.2 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.748 1.158 . . . . 0.0 113.278 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -45.24 124.29 4.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.835 2.454 . . . . 0.0 113.216 169.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 2.5 mp -115.11 88.44 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.051 1.74 . . . . 0.0 107.399 165.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -64.82 150.69 47.11 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.384 0.674 . . . . 0.0 112.504 -175.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 37.1 mttp -66.41 151.87 95.41 Favored Pre-proline 0 CA--C 1.551 0.99 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -71.42 131.28 20.65 Favored 'Cis proline' 0 CA--C 1.542 0.88 0 CA-C-N 118.866 0.631 . . . . 0.0 111.512 -10.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 32.8 p30 -119.72 1.12 11.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.408 1.483 . . . . 0.0 113.875 -176.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.71 -41.97 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.446 1.021 . . . . 0.0 113.035 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.69 -44.01 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.77 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 13.9 m -53.84 -48.61 69.78 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 111.866 175.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 92.5 mt -70.46 -38.24 74.44 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.626 1.57 . . . . 0.0 112.941 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 41.3 mt -59.68 -35.15 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.252 1.021 . . . . 0.0 111.632 172.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -75.28 -12.84 60.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 175.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -82.06 169.46 16.67 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.097 1.317 . . . . 0.0 111.902 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.66 12.79 24.23 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.25 1.82 . . . . 0.0 113.879 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 86.9 mt -48.64 116.34 5.12 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 127.201 2.2 . . . . 0.0 113.007 -173.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -75.05 178.43 7.29 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.997 3.131 . . . . 0.0 113.017 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 51.5 mtt -132.93 100.32 4.86 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.861 1.265 . . . . 0.0 110.189 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 10.6 m -71.16 -25.74 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 124.482 1.113 . . . . 0.0 113.727 -172.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 95.1 p -120.61 -1.89 10.0 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.917 2.087 . . . . 0.0 114.17 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 95.13 -4.51 67.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.173 1.368 . . . . 0.0 113.785 -161.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -147.39 -50.4 0.19 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 118.72 1.26 . . . . 0.0 113.895 170.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -65.8 155.05 37.4 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -171.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -130.4 133.85 63.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.157 1.783 . . . . 0.0 110.521 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -72.56 137.04 45.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.853 1.661 . . . . 0.0 113.553 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 29.0 p -46.12 -56.32 5.79 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.99 1.716 . . . . 0.0 114.949 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 87.3 mmm -68.94 -27.78 66.05 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.97 -36.56 69.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.915 0.779 . . . . 0.0 111.752 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 26.9 mt -64.69 -49.5 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.087 0.955 . . . . 0.0 110.032 170.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.68 -49.16 68.61 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.96 1.304 . . . . 0.0 111.166 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 51.7 t80 -56.3 -49.07 75.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.329 1.452 . . . . 0.0 112.517 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -60.28 -47.43 86.02 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.203 -0.935 . . . . 0.0 112.671 174.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -67.16 -36.83 82.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.644 1.178 . . . . 0.0 112.64 -177.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 39.6 p -74.01 -42.98 59.55 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.089 0.956 . . . . 0.0 112.729 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -54.29 -39.59 67.08 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 120.085 1.311 . . . . 0.0 113.063 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -52.09 -47.38 65.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.094 1.758 . . . . 0.0 112.929 171.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 41.0 t -73.15 -43.04 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.905 1.282 . . . . 0.0 111.474 177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.12 -15.25 63.6 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.14 1.776 . . . . 0.0 113.74 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 80.1 20.17 68.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.918 1.247 . . . . 0.0 113.673 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -99.58 2.49 44.71 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.603 1.561 . . . . 0.0 114.198 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.444 1.498 . . . . 0.0 113.382 173.971 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.76 174.88 10.43 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 124.116 3.211 . . . . 0.0 112.964 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -153.18 -178.27 27.58 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.66 1.6 . . . . 0.0 113.676 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.5 m -141.07 164.13 31.09 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.193 1.797 . . . . 0.0 111.746 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1773 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 44.9 80.62 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.478 2.311 . . . . 0.0 114.784 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1774 ' ' ASN . . . . . . . . . . . . . 10.2 t-20 58.84 25.34 13.46 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.682 1.993 . . . . 0.0 115.234 172.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1775 ' ' PHE . . . . . . . . . . . . . 21.4 p90 -59.86 -14.59 15.9 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.409 1.633 . . . . 0.0 115.409 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1776 ' ' SER . . . . . . . . . . . . . 47.0 m -71.79 68.99 0.65 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.206 1.802 . . . . 0.0 112.254 172.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1777 ' ' VAL . . . . . . . . . . . . . 30.4 m -71.82 -6.93 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -174.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1778 ' ' ALA . . . . . . . . . . . . . . . 54.43 24.94 5.6 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 126.812 2.045 . . . . 0.0 115.226 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1779 ' ' THR . . . . . . . . . . . . . 9.5 t -144.18 -173.92 4.14 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.09 2.156 . . . . 0.0 111.124 178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1780 ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -57.72 152.58 15.19 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.618 1.567 . . . . 0.0 112.879 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1781 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.32 -7.39 52.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -177.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1782 ' ' SER . . . . . . . . . . . . . 69.9 m -139.35 155.39 47.71 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.725 2.01 . . . . 0.0 111.037 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1783 ' ' THR . . . . . . . . . . . . . 22.0 m -137.84 94.82 2.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.765 1.226 . . . . 0.0 111.092 -174.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1784 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.73 154.96 94.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.899 0.88 . . . . 0.0 111.896 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1785 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.92 -6.68 16.95 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.553 2.835 . . . . 0.0 113.9 -178.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1786 ' ' LEU . . . . . . . . . . . . . 67.3 mt -130.39 156.95 43.87 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.958 2.103 . . . . 0.0 110.815 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1787 ' ' SER . . . . . . . . . . . . . 83.5 p -143.82 176.37 9.3 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.678 1.591 . . . . 0.0 112.485 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1788 ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.62 -25.25 66.14 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 174.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1789 ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.9 -37.64 84.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.057 0.943 . . . . 0.0 112.694 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1790 ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -67.7 -41.26 83.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.799 0.84 . . . . 0.0 111.39 174.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1791 ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -67.75 -42.77 81.26 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.027 0.531 . . . . 0.0 111.986 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1792 ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.19 -41.91 89.63 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.102 0.961 . . . . 0.0 112.399 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1793 ' ' MET . . . . . . . . . . . . . 64.7 ttp -57.59 -49.51 76.16 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.531 0.732 . . . . 0.0 111.312 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1794 ' ' PHE . . . . . . . . . . . . . 41.6 t80 -54.93 -51.25 66.68 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.764 0.711 . . . . 0.0 112.361 175.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1795 ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.3 -39.01 88.89 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.017 0.927 . . . . 0.0 113.384 178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1796 ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.78 -51.67 63.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.974 0.91 . . . . 0.0 111.909 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1797 ' ' ILE . . . . . . . . . . . . . 50.3 mm -69.88 -29.48 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 123.985 0.914 . . . . 0.0 112.004 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1798 ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -57.76 -43.11 85.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.793 1.237 . . . . 0.0 112.795 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1799 ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -60.72 -24.01 65.35 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.743 1.217 . . . . 0.0 113.196 -177.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1800 ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -66.54 -24.58 66.39 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.032 1.733 . . . . 0.0 113.239 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1801 ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -112.05 -20.01 12.11 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.58 1.952 . . . . 0.0 112.956 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1802 ' ' ASP . . . . . . . . . . . . . 37.8 t0 -124.9 74.55 65.63 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.367 1.867 . . . . 0.0 111.225 174.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1803 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.7 -14.25 24.48 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.909 2.406 . . . . 0.0 112.676 174.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1804 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.6 -14.17 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.863 1.665 . . . . 0.0 113.68 174.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1805 ' ' ALA . . . . . . . . . . . . . . . 54.13 25.49 5.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.222 1.809 . . . . 0.0 113.554 -168.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1806 ' ' THR . . . . . . . . . . . . . 2.9 t -68.71 -12.98 62.07 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.187 1.395 . . . . 0.0 113.449 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1807 ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 67.52 18.69 10.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.45 2.3 . . . . 0.0 113.881 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1808 ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -131.38 150.7 52.05 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.81 2.044 . . . . 0.0 111.784 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1809 ' ' ILE . . . . . . . . . . . . . 38.5 pt -137.81 162.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.337 1.455 . . . . 0.0 111.139 165.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1810 ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -76.98 151.61 35.58 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.985 0.914 . . . . 0.0 112.671 173.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1811 ' ' TYR . . . . . . . . . . . . . 12.3 t80 -56.9 -36.39 70.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.823 0.849 . . . . 0.0 112.8 176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1812 ' ' SER . . . . . . . . . . . . . 23.5 m -63.35 -19.18 64.41 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.274 1.83 . . . . 0.0 114.703 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1813 ' ' VAL . . . . . . . . . . . . . 33.9 m -115.52 -13.58 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 124.864 1.266 . . . . 0.0 113.387 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1814 ' ' LEU . . . . . . . . . . . . . 3.6 tt -54.34 -42.67 70.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.578 1.151 . . . . 0.0 110.573 166.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1815 ' ' SER . . . . . . . . . . . . . 15.6 m -55.59 -42.86 75.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.605 1.162 . . . . 0.0 113.2 174.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1816 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.31 -37.23 53.05 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.477 -0.765 . . . . 0.0 112.165 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1817 ' ' PHE . . . . . . . . . . . . . 35.0 t80 -58.51 -46.49 86.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.388 1.475 . . . . 0.0 112.536 170.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1818 ' ' ALA . . . . . . . . . . . . . . . -56.5 -28.41 59.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.101 1.36 . . . . 0.0 113.175 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1819 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.73 -6.7 45.55 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.425 1.49 . . . . 0.0 114.08 175.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1820 ' ' ALA . . . . . . . . . . . . . . . -88.72 -20.12 25.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.676 -1.265 . . . . 0.0 113.169 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1821 ' ' LEU . . . . . . . . . . . . . 7.7 mt -73.47 171.04 13.88 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.009 2.124 . . . . 0.0 112.076 177.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1822 ' ' SER . . . . . . . . . . . . . 4.8 t -101.41 165.58 11.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.331 0.653 . . . . 0.0 111.043 161.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1823 ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.73 155.53 69.75 Favored Pre-proline 0 CA--C 1.556 1.176 0 O-C-N 121.453 -0.78 . . . . 0.0 111.084 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1824 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -69.86 -21.19 10.48 Favored 'Cis proline' 0 CA--C 1.54 0.815 0 N-CA-C 116.003 1.501 . . . . 0.0 116.003 -6.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1825 ' ' LEU . . . . . . . . . . . . . 73.4 mt -68.03 -25.67 65.49 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1826 ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -51.49 137.21 24.58 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.437 2.295 . . . . 0.0 113.702 169.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1827 ' ' ILE . . . . . . . . . . . . . 4.2 mp -124.68 96.14 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.763 2.025 . . . . 0.0 107.796 163.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1828 ' ' ALA . . . . . . . . . . . . . . . -60.98 145.29 51.13 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 112.821 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1829 ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.09 154.62 86.39 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.12 0.968 . . . . 0.0 113.055 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1830 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.06 131.41 20.7 Favored 'Cis proline' 0 CA--C 1.542 0.918 0 CA-C-N 118.827 0.617 . . . . 0.0 111.513 -10.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1831 ' ' ASN . . . . . . . . . . . . . 47.8 p30 -124.19 1.42 8.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.123 1.369 . . . . 0.0 114.508 -172.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1832 ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -57.33 -35.66 70.16 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.844 1.202 . . . . 0.0 112.68 174.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1833 ' ' ILE . . . . . . . . . . . . . 41.0 mm -70.88 -38.55 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.33 . . . . 0.0 110.625 175.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1834 ' ' SER . . . . . . . . . . . . . 10.5 m -58.03 -47.16 83.92 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.227 1.411 . . . . 0.0 111.722 174.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1835 ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.34 -41.13 92.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.69 0.677 . . . . 0.0 112.179 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1836 ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.47 -31.79 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 124.715 1.206 . . . . 0.0 111.696 177.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1837 ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -80.05 -19.79 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 175.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1838 ' ' MET . . . . . . . . . . . . . 67.5 mtt -75.45 167.35 22.06 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.482 1.113 . . . . 0.0 112.17 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1839 ' ' ASP . . . . . . . . . . . . . 25.2 t70 -89.61 13.93 12.85 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.3 1.84 . . . . 0.0 113.311 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1840 ' ' LEU . . . . . . . . . . . . . 70.7 mt -49.73 119.34 9.64 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 126.899 2.079 . . . . 0.0 112.623 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1841 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -76.38 -179.56 5.41 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.002 3.135 . . . . 0.0 112.221 177.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1842 ' ' MET . . . . . . . . . . . . . 64.3 mtt -136.81 121.13 18.05 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.602 1.161 . . . . 0.0 110.336 166.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1843 ' ' VAL . . . . . . . . . . . . . 22.7 m -76.03 -20.55 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1844 ' ' SER . . . . . . . . . . . . . 89.2 p -129.74 -9.63 4.48 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.915 2.086 . . . . 0.0 114.18 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1845 ' ' GLY . . . . . . . . . . . . . . . 89.65 -0.67 80.42 Favored Glycine 0 CA--C 1.544 1.869 0 C-N-CA 125.116 1.341 . . . . 0.0 114.326 -163.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1846 ' ' ASP . . . . . . . . . . . . . 2.5 p30 -145.79 -17.92 0.46 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 175.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1847 ' ' ARG . . . . . . . . . . . . . 50.9 mtt85 -117.5 157.94 25.4 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.77 1.628 . . . . 0.0 112.888 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1848 ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.61 135.07 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 126.238 1.815 . . . . 0.0 109.98 -169.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1849 ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -77.8 139.66 39.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.037 2.135 . . . . 0.0 113.662 -175.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1850 ' ' CYS . . . . . . . . . . . . . 31.7 p -51.28 -48.77 62.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.568 1.547 . . . . 0.0 114.901 -175.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1851 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -38.61 91.55 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.726 0.81 . . . . 0.0 112.404 -178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1852 ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -69.6 -35.54 75.4 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.203 1.001 . . . . 0.0 111.94 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1853 ' ' ILE . . . . . . . . . . . . . 62.9 mt -64.4 -51.21 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.754 1.222 . . . . 0.0 110.484 171.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1854 ' ' LEU . . . . . . . . . . . . . 65.0 tp -54.69 -51.06 66.72 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.298 0.499 . . . . 0.0 111.116 174.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1855 ' ' PHE . . . . . . . . . . . . . 59.9 t80 -54.14 -47.36 71.98 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.12 1.368 . . . . 0.0 112.831 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1856 ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.98 84.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 173.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1857 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -71.6 -35.13 70.4 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1858 ' ' THR . . . . . . . . . . . . . 44.1 p -81.42 -29.37 33.9 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -176.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1859 ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -53.34 -46.07 69.35 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 120.405 1.457 . . . . 0.0 113.417 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1860 ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -64.91 -24.5 67.55 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1861 ' ' VAL . . . . . . . . . . . . . 15.3 t -80.99 -42.38 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.227 1.411 . . . . 0.0 110.723 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1862 ' ' LEU . . . . . . . . . . . . . 67.8 mt -73.56 -16.42 61.26 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.226 1.81 . . . . 0.0 114.156 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1863 ' ' GLY . . . . . . . . . . . . . . . 86.44 12.51 69.78 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.861 1.22 . . . . 0.0 114.627 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1864 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -96.2 -2.46 46.2 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.173 1.789 . . . . 0.0 113.605 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1865 ' ' SER . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.255 1.386 0 C-N-CA 126.599 1.96 . . . . 0.0 114.359 174.529 . . . . . . . . 0 0 . 1 stop_ save_